SCHEMBL7437418

SCHEMBL7437418

Cc1ccccc1CC(C(=O)O)C(=O)O

nearest known ligand 0.66

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.58
PPARG P37231 2/20 0.54
PPARA Q07869 1/20 0.54
HPGD P15428 2/20 0.49
ALDH1A1 P00352 2/20 0.49
CTBP2 P56545 1/20 0.49
HTT P42858 1/20 0.45
GAA P10253 1/20 0.45
KDM4E B2RXH2 1/20 0.44
LMNA P02545 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.42
CTNNB1 P35222 1/20 0.42

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
SCHEMBL9165065 0.90 PPARG (0.50) KMT2APPARGPPARAHPGDALDH1A1
SCHEMBL27559397 0.89 KMT2A (0.51) KMT2APPARGPPARAHPGDALDH1A1
SCHEMBL7384644 0.86 PPARG (0.57) PPARGPPARAHPGDALDH1A1CTBP2
SCHEMBL6688791 0.86 PPARG (0.49) KMT2APPARGPPARAHPGDALDH1A1
SCHEMBL8053590 0.84 KMT2A (0.50) KMT2APPARGPPARAHPGDALDH1A1
SCHEMBL7629121 0.84 KDM4E (0.53) KMT2APPARGPPARAHPGDALDH1A1
SCHEMBL17101190 0.84 KMT2A (0.46) KMT2APPARGPPARAHPGDALDH1A1
SCHEMBL1826830 0.84 PPARG (0.51) KMT2APPARGPPARAHPGDALDH1A1
SCHEMBL10170669 0.84 PPARG (0.51) KMT2APPARGPPARAHPGDALDH1A1
SCHEMBL19295493 0.84 KDM4E (0.53) KMT2APPARGPPARAHPGDALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10954211-B2 Chemical compounds ASTRAZENECA AB (SE) 2021-03-23 US disclosed
CN-106103423-B Pyrazine compounds 阿斯利康(瑞典)有限公司 2019-12-06 CN disclosed
US-20190330187-A1 Chemical Compounds ASTRAZENECA UK LIMITED (GB) 2019-10-31 US disclosed
US-10336725-B2 Chemical compounds ASTRAZENECA AB (SE) 2019-07-02 US disclosed
US-20180162838-A1 Chemical Compounds ASTRAZENECA AB (SE) 2018-06-14 US disclosed
EP-3119752-B1 3,4-DIAMINO-6-CHLOROPYRAZINE-2-CARBOXAMIDE COMPOUNDS FOR THE TREATMENT OF ENAC MEDIATED DISEASES ASTRAZENECA AB (SE) 2018-05-16 EP disclosed
US-9873678-B2 Chemical compounds ASTRAZENECA AB (SE) 2018-01-23 US disclosed
US-20170107195-A1 Chemical Compounds ASTRAZENECA AB (SE) 2017-04-20 US disclosed
EP-3119752-A1 CHEMICAL COMPOUNDS Astrazeneca AB (SE) 2017-01-25 EP disclosed
CN-106103423-A Chemical compound 阿斯利康(瑞典)有限公司 2016-11-09 CN disclosed
US-20070154948-A1 Novel antibacterial agents THERAVANCE BIOPHARMA ANTIBIOTICS IP, LLC 2007-07-05 US disclosed
US-20070134729-A1 Novel antibacterial agents THERAVANCE BIOPHARMA ANTIBIOTICS IP, LLC 2007-06-14 US disclosed
US-20070134729-A1 Novel antibacterial agents THERAVANCE BIOPHARMA ANTIBIOTICS IP, LLC 2007-06-14 US disclosed
US-7211695-B2 β2-adrenergic receptor agonists THERAVANCE, INC. (US) 2007-05-01 US disclosed
US-7211695-B2 β2-adrenergic receptor agonists THERAVANCE, INC. (US) 2007-05-01 US disclosed
US-7179794-B2 Multivalent macrolide antibiotics THERAVANCE, INC. (US) 2007-02-20 US disclosed
US-7179794-B2 Multivalent macrolide antibiotics THERAVANCE, INC. (US) 2007-02-20 US disclosed
US-7173039-B2 Protein kinase inhibitors THERAVANCE, INC. (US) 2007-02-06 US disclosed
US-4929641-A DIURETICS, ANGIOTENSIN CONVERTING ENZYMES SCHERING CORPORATION (US) 1990-05-29 US disclosed
US-4329495-A USEFUL AS ANALGESICS OR ANTICONVULSANTS, CHIRAL 2-(2-BENZYL-3-MERCAPTOPROPIONYLAMINO)-THIOBUTYRIC ACIDS, OR ALKANOL DERIVATIVES PFIZER INC. (US) 1982-05-11 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 (7 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-20070134729-A1 Novel antibacterial agents ENGASE, PGLS, PEPD KMT2A 3543/4885PPARG 3581/4885PPARA 3639/4885
US-20170107195-A1 Chemical Compounds CFTR, SCNN1B, SCNN1A KMT2A 2821/4885PPARG 1460/4885PPARA 3101/4885
US-10336725-B2 Chemical compounds CFTR, SCNN1B, SCNN1A KMT2A 2821/4885PPARG 1460/4885PPARA 3101/4885
US-20180162838-A1 Chemical Compounds CFTR, SCNN1B, SCNN1A KMT2A 2821/4885PPARG 1460/4885PPARA 3101/4885
US-10954211-B2 Chemical compounds CFTR, SCNN1B, SCNN1A KMT2A 2821/4885PPARG 1460/4885PPARA 3101/4885
US-20190330187-A1 Chemical Compounds CFTR, SCNN1B, SCNN1A KMT2A 2821/4885PPARG 1460/4885PPARA 3101/4885
US-20070154948-A1 Novel antibacterial agents ENGASE, PGLS, PEPD KMT2A 3543/4885PPARG 3581/4885PPARA 3639/4885

“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.