SCHEMBL19306557

SCHEMBL19306557

C#CC[C@@H](CCCCC)C(=O)O

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA2 P00918 2/20 0.53
MAPK1 P28482 1/20 0.53
GRIK1 P39086 4/20 0.53
GRIK2 Q13002 4/20 0.53
SLC1A2 P43004 2/20 0.53
SLC1A1 P43005 2/20 0.53
GPR84 Q9NQS5 5/20 0.47
FFAR1 O14842 1/20 0.47
SLC1A3 P43003 1/20 0.46
MAPT P10636 1/20 0.46
LCK P06239 1/20 0.46
PPARD Q03181 1/20 0.46
ZDHHC20 Q5W0Z9 1/20 0.46
ZDHHC2 Q9UIJ5 1/20 0.46
CHRM1 P11229 1/20 0.45
AKR1A1 P14550 1/20 0.45
CHRM3 P20309 1/20 0.45
HTR2A P28223 1/20 0.45
HTR2C P28335 1/20 0.45
ADRA1A P35348 1/20 0.45

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL3839934 1.00 CA2 (0.53) CA2MAPK1GRIK1GRIK2SLC1A2
SCHEMBL7552288 1.00 CA2 (0.53) CA2MAPK1GRIK1GRIK2SLC1A2
SCHEMBL3785993 0.98 GRIK1 (0.54) CA2MAPK1GRIK1GRIK2SLC1A2
SCHEMBL7550232 0.98 GRIK1 (0.54) CA2MAPK1GRIK1GRIK2SLC1A2
SCHEMBL3864872 0.98 GRIK1 (0.54) CA2MAPK1GRIK1GRIK2SLC1A2
SCHEMBL7552503 0.98 GRIK1 (0.54) CA2MAPK1GRIK1GRIK2SLC1A2
SCHEMBL3857718 0.98 GRIK1 (0.54) CA2MAPK1GRIK1GRIK2SLC1A2
SCHEMBL7551496 0.94 CA2 (0.61) CA2MAPK1GRIK1GRIK2SLC1A2
SCHEMBL8847217 0.86 GRIK1 (0.42) CA2MAPK1GRIK1GRIK2SLC1A2
SCHEMBL7557794 0.86 CHRM1 (0.62) CA2MAPK1GRIK1GRIK2SLC1A2

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 24 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240341301-A1 ITACONATE AND DERIVATIVES THEREOF FOR THE PROTECTION OF CELLS, TISSUES, AND ORGANS UNIV MICHIGAN REGENTS (US) 2024-10-17 US disclosed
US-20230241076-A1 HISTONE-ACETYLATION-MODULATING AGENTS FOR THE TREATMENT AND PREVENTION OF ORGAN INJURY THE REGENTS OF THE UNIVERSITY OF MICHIGAN 2023-08-03 US disclosed
US-20230241076-A1 HISTONE-ACETYLATION-MODULATING AGENTS FOR THE TREATMENT AND PREVENTION OF ORGAN INJURY THE REGENTS OF THE UNIVERSITY OF MICHIGAN 2023-08-03 US disclosed
US-20230069590-A1 CONCENTRATED SODIUM VALPROATE FOR RAPID DELIVERY THE REGENTS OF THE UNIVERSITY OF MICHIGAN 2023-03-02 US disclosed
US-20230058189-A1 QUINOLIN-4-ONE AND 4(1H)-CINNOLINONE COMPOUNDS AND METHODS OF USING SAME Frequency Therapeutics, Inc. (US) 2023-02-23 US disclosed
CN-114340611-A Combination of CHIR99021 and valproic acid for the treatment of hearing loss 频率医疗公司 2022-04-12 CN disclosed
US-11260130-B2 Solubilized compositions for controlled proliferation of stem cells / generating inner ear hair cells using a GSK3 inhibitor: IV Frequency Therapeutics, Inc. (US) 2022-03-01 US disclosed
EP-3952854-A1 COMBINATION OF CHIR99021 AND VALPROIC ACID FOR TREATING HEARING LOSS Frequency Therapeutics, Inc. (US) 2022-02-16 EP disclosed
US-20210300948-A1 1H-PYRROLE-2,5-DIONE COMPOUNDS AND METHODS OF USING THEM TO INDUCE SELF-RENEWAL OF STEM/PROGENITOR SUPPORTING CELLS Frequency Therapeutics, Inc. 2021-09-30 US disclosed
US-11066419-B2 1H-pyrrole-2,5-dione compounds and methods of using same Frequency Therapeutics, Inc. (US) 2021-07-20 US disclosed
US-10383881-B2 1,5-dihydro-2H-pyrrol-2-one compounds and methods of using same Frequency Therapeutics, Inc. (US) 2019-08-20 US disclosed
US-20190201398-A1 SOLUBILIZED COMPOSITIONS FOR CONTROLLED PROLIFERATION OF STEM CELLS / GENERATING INNER EAR HAIR CELLS USING A GSK3 INHIBITOR: I Frequency Therapeutics, Inc. 2019-07-04 US disclosed
US-20190093079-A1 METHODS FOR CONTROLLED PROLIFERATION OF STEM CELLS / GENERATING INNER EAR HAIR CELLS USING GSK-3-ALPHA INHIBITORS Frequency Therapeutics, Inc. 2019-03-28 US disclosed
US-10201540-B2 Solubilized compositions for controlled proliferation of stem cells / generating inner ear hair cells using GSK3 inhibitors: I Frequency Therapeutics, Inc. (US) 2019-02-12 US disclosed
US-20180214458-A1 1,5-DIHYDRO-2H-PYRROL-2-ONE COMPOUNDS AND METHODS OF USING SAME Frequency Therapeutics, Inc. 2018-08-02 US disclosed
US-10016507-B2 Solubilized compositions for controlled proliferation of stem cells / generating inner ear hair cells using GSK3 inhibitors: III Frequency Therapeutics, Inc. (US) 2018-07-10 US disclosed
US-20170252329-A1 SOLUBILIZED COMPOSITIONS FOR CONTROLLED PROLIFERATION OF STEM CELLS / GENERATING INNER EAR HAIR CELLS USING GSK3 INHIBITORS: II Frequency Therapeutics, Inc. 2017-09-07 US disclosed
US-20170252449-A1 SOLUBILIZED COMPOSITIONS FOR CONTROLLED PROLIFERATION OF STEM CELLS / GENERATING INNER EAR HAIR CELLS USING GSK3 INHIBITORS: III Frequency Therapeutics, Inc. 2017-09-07 US disclosed
US-20170252450-A1 SOLUBILIZED COMPOSITIONS FOR CONTROLLED PROLIFERATION OF STEM CELLS / GENERATING INNER EAR HAIR CELLS USING A GSK3 INHIBITOR: IV Frequency Therapeutics, Inc. 2017-09-07 US disclosed
US-20170252340-A1 SOLUBILIZED COMPOSITIONS FOR CONTROLLED PROLIFERATION OF STEM CELLS / GENERATING INNER EAR HAIR CELLS USING GSK3 INHIBITORS: I Frequency Therapeutics, Inc. 2017-09-07 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (17 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20230241076-A1 HISTONE-ACETYLATION-MODULATING AGENTS FOR THE TREATMENT AND PREVENTION OF ORGAN INJURY HDAC2, HDAC1, CREBBP CA2 1912/4885MAPK1 1913/4885GRIK1 1140/4885
US-20170252450-A1 SOLUBILIZED COMPOSITIONS FOR CONTROLLED PROLIFERATION OF STEM CELLS / GENERATING INNER EAR HAIR CELLS USING A GSK3 INHIBITOR: IV GSK3B, GSK3A, GSKIP CA2 1649/4885MAPK1 443/4885GRIK1 2770/4885
US-10016507-B2 Solubilized compositions for controlled proliferation of stem cells / generating inner ear hair cells using GSK3 inhibitors: III GSK3B, GSK3A, GSKIP CA2 1523/4885MAPK1 316/4885GRIK1 2547/4885
US-20170252329-A1 SOLUBILIZED COMPOSITIONS FOR CONTROLLED PROLIFERATION OF STEM CELLS / GENERATING INNER EAR HAIR CELLS USING GSK3 INHIBITORS: II GSK3B, GSK3A, GSKIP CA2 1205/4885MAPK1 341/4885GRIK1 2531/4885
US-20230069590-A1 CONCENTRATED SODIUM VALPROATE FOR RAPID DELIVERY CACNA1G, CACNA1C, CACNA1H CA2 292/4885MAPK1 4043/4885GRIK1 46/4885
US-20210300948-A1 1H-PYRROLE-2,5-DIONE COMPOUNDS AND METHODS OF USING THEM TO INDUCE SELF-RENEWAL OF STEM/PROGENITOR SUPPORTING CELLS MCL1, PROX1, MKI67 CA2 4491/4885MAPK1 3170/4885GRIK1 3223/4885
US-10201540-B2 Solubilized compositions for controlled proliferation of stem cells / generating inner ear hair cells using GSK3 inhibitors: I GSK3B, GSK3A, GSKIP CA2 1521/4885MAPK1 244/4885GRIK1 2240/4885
US-20180214458-A1 1,5-DIHYDRO-2H-PYRROL-2-ONE COMPOUNDS AND METHODS OF USING SAME DCX, MKI67, MCL1 CA2 4173/4885MAPK1 2194/4885GRIK1 2809/4885
US-20190093079-A1 METHODS FOR CONTROLLED PROLIFERATION OF STEM CELLS / GENERATING INNER EAR HAIR CELLS USING GSK-3-ALPHA INHIBITORS GSK3A, GSK3B, NOTCH3 CA2 668/4885MAPK1 1778/4885GRIK1 595/4885
US-20170252449-A1 SOLUBILIZED COMPOSITIONS FOR CONTROLLED PROLIFERATION OF STEM CELLS / GENERATING INNER EAR HAIR CELLS USING GSK3 INHIBITORS: III GSK3B, GSK3A, GSKIP CA2 1523/4885MAPK1 316/4885GRIK1 2547/4885
US-20170252340-A1 SOLUBILIZED COMPOSITIONS FOR CONTROLLED PROLIFERATION OF STEM CELLS / GENERATING INNER EAR HAIR CELLS USING GSK3 INHIBITORS: I GSK3B, GSK3A, GSKIP CA2 1521/4885MAPK1 244/4885GRIK1 2240/4885
US-10383881-B2 1,5-dihydro-2H-pyrrol-2-one compounds and methods of using same DCX, MKI67, MCL1 CA2 4173/4885MAPK1 2194/4885GRIK1 2809/4885
US-20230058189-A1 QUINOLIN-4-ONE AND 4(1H)-CINNOLINONE COMPOUNDS AND METHODS OF USING SAME DCX, NES, MCL1 CA2 4078/4885MAPK1 1437/4885GRIK1 1886/4885
US-20190201398-A1 SOLUBILIZED COMPOSITIONS FOR CONTROLLED PROLIFERATION OF STEM CELLS / GENERATING INNER EAR HAIR CELLS USING A GSK3 INHIBITOR: I GSK3B, GSK3A, GSKIP CA2 1639/4885MAPK1 313/4885GRIK1 2378/4885
US-11066419-B2 1H-pyrrole-2,5-dione compounds and methods of using same MKI67, PROX1, DCX CA2 4161/4885MAPK1 2543/4885GRIK1 3429/4885
US-20240341301-A1 ITACONATE AND DERIVATIVES THEREOF FOR THE PROTECTION OF CELLS, TISSUES, AND ORGANS TNNI3, ALDH2, ALDH5A1 CA2 2897/4885MAPK1 3714/4885GRIK1 3458/4885
US-11260130-B2 Solubilized compositions for controlled proliferation of stem cells / generating inner ear hair cells using a GSK3 inhibitor: IV GSK3B, GSK3A, GSKIP CA2 1649/4885MAPK1 443/4885GRIK1 2770/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.