SCHEMBL16798232

SCHEMBL16798232

CCCC(CC(=O)OC(C)(C)C)C(=O)O

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HDAC1 Q13547 2/20 0.54
HDAC2 Q92769 2/20 0.54
CHRM1 P11229 1/20 0.54
AKR1A1 P14550 1/20 0.54
CHRM3 P20309 1/20 0.54
HTR2A P28223 1/20 0.54
HTR2C P28335 1/20 0.54
ADRA1A P35348 1/20 0.54
HRH1 P35367 1/20 0.54
DRD3 P35462 1/20 0.54
SLC6A3 Q01959 1/20 0.54
TDP1 Q9NUW8 1/20 0.54
MEN1 O00255 1/20 0.45
GAA P10253 1/20 0.45
KMT2A Q03164 1/20 0.45
SLC1A2 P43004 3/20 0.43
SLC1A1 P43005 3/20 0.43
GRIK1 P39086 3/20 0.43
GRIK2 Q13002 3/20 0.43
SLC1A3 P43003 2/20 0.43

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
SCHEMBL7051239 1.00 HDAC1 (0.54) HDAC1HDAC2CHRM1AKR1A1CHRM3
SCHEMBL6448846 1.00 HDAC1 (0.54) HDAC1HDAC2CHRM1AKR1A1CHRM3
SCHEMBL1915651 0.91 CA2 (0.55) HDAC1HDAC2CHRM1AKR1A1CHRM3
SCHEMBL1915653 0.91 CA2 (0.55) HDAC1HDAC2CHRM1AKR1A1CHRM3
SCHEMBL6161042 0.89 GRIK1 (0.49) HDAC1HDAC2CHRM1AKR1A1CHRM3
SCHEMBL6161064 0.89 GRIK1 (0.49) HDAC1HDAC2CHRM1AKR1A1CHRM3
SCHEMBL8217023 0.88 GRIK1 (0.50) MEN1GAAKMT2ASLC1A2SLC1A1
SCHEMBL6808467 0.88 GRIK1 (0.50) MEN1GAAKMT2ASLC1A2SLC1A1
SCHEMBL7069281 0.88 GRIK1 (0.50) MEN1GAAKMT2ASLC1A2SLC1A1
SCHEMBL7075183 0.88 GRIK1 (0.50) MEN1GAAKMT2ASLC1A2SLC1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110358752-A A kind of Aspergillus oryzae lipase and preparing the application in Bu Waxitan chiral intermediate 浙江工业大学 2019-10-22 CN claimed
WO-2018220646-A1 AN IMPROVED PROCESS FOR THE PREPARATION OF (2S)-2-[(4R)-2-OXO-4-PROPYLTETRAHYDRO-1H-PYRROL-1-YL] BUTANAMIDE AND ITS INTERMEDIATES THEREOF MSN LABORATORIES PRIVATE LIMITED, R&D CENTER (IN) 2018-12-06 WO claimed
CN-115286504-B Method for synthesizing (R) -2- (2- (tert-butoxy) -2-oxyethyl) pentanoic acid 上海博氏医药科技有限公司 2024-01-26 CN disclosed
US-11813306-B2 Cyclic tetramer compounds as proprotein convertase subtilisin/kexin type 9 (PCSK9) inhibitors for the treatment of metabolic disorders NOVARTIS AG (CH) 2023-11-14 US disclosed
CN-115286504-A Method for synthesizing (R) -2- (2- (tert-butoxy) -2-oxyethyl) pentanoic acid 上海博氏医药科技有限公司 2022-11-04 CN disclosed
US-11376260-B2 Serine/threonine kinase inhibitors GENENTECH, INC. (US) 2022-07-05 US disclosed
CN-111675643-B Preparation method of brivaracetam 浙江天宇药业股份有限公司 2021-10-26 CN disclosed
EP-3887365-A1 CYCLIC TETRAMER COMPOUNDS AS PROPROTEIN CONVERTASE SUBTILISIN/KEXIN TYPE 9 (PCSK9) INHIBITORS FOR THE TREATMENT OF METABOLIC DISORDERS Novartis AG (CH) 2021-10-06 EP disclosed
US-20210252103-A1 CYCLIC TETRAMER COMPOUNDS AS PROPROTEIN CONVERTASE SUBTILISIN/KEXIN TYPE 9 (PCSK9) INHIBITORS FOR THE TREATMENT OF METABOLIC DISORDERS NOVARTIS AG (CH) 2021-08-19 US disclosed
US-11026993-B2 Cyclic tetramer compounds as proprotein convertase subtilisin/kexin type 9 (PCSK9) inhibitors for the treatment of metabolic disorders NOVARTIS AG (CH) 2021-06-08 US disclosed
US-20210163410-A1 AN IMPROVED PROCESS FOR THE PREPARATION OF (2S)-2-[(4R)-2-OXO-4-PROPYLTETRAHYDRO-1H-PYRROL-1-YL] BUTANAMIDE AND ITS INTERMEDIATES THEREOF MSN LABORATORIES PRIVATE LIMITED, R&D CENTER (IN) 2021-06-03 US disclosed
WO-2018220646-A1 AN IMPROVED PROCESS FOR THE PREPARATION OF (2S)-2-[(4R)-2-OXO-4-PROPYLTETRAHYDRO-1H-PYRROL-1-YL] BUTANAMIDE AND ITS INTERMEDIATES THEREOF MSN LABORATORIES PRIVATE LIMITED, R&D CENTER (IN) 2018-12-06 WO disclosed
EP-3077401-B1 SERINE/THREONINE KINASE INHIBITORS GENENTECH INC (US) 2018-04-18 EP disclosed
US-9867833-B2 Serine/threonine kinase inhibitors GENENTECH, INC. (US) 2018-01-16 US disclosed
US-20180000833-A1 SERINE/THREONINE KINASE INHIBITORS GENENTECH, INC. (US) 2018-01-04 US disclosed
EP-2897938-B1 FLUOROALKYL DIBENZODIAZEPINONE COMPOUNDS BRISTOL MYERS SQUIBB CO (US) 2017-03-15 EP disclosed
EP-3077401-A1 SERINE/THREONINE KINASE INHIBITORS Genentech, Inc. (US) 2016-10-12 EP disclosed
CN-106008411-A Method for preparing chiral 4-substituted dihydrofuran-2(3H)-ketone 上海华默西医药科技有限公司 2016-10-12 CN disclosed
US-20150182537-A1 SERINE/THREONINE KINASE INHIBITORS GENENTECH, INC. (US) 2015-07-02 US disclosed
WO-2015085007-A1 SERINE/THREONINE KINASE INHIBITORS GENENTECH, INC. (US) 2015-06-11 WO 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-20210252103-A1 CYCLIC TETRAMER COMPOUNDS AS PROPROTEIN CONVERTASE SUBTILISIN/KEXIN TYPE 9 (PCSK9) INHIBITORS FOR THE TREATMENT OF METABOLIC DISORDERS PCSK9, PCSK7, PCSK6 HDAC1 530/4885HDAC2 2194/4885CHRM1 583/4885
US-11026993-B2 Cyclic tetramer compounds as proprotein convertase subtilisin/kexin type 9 (PCSK9) inhibitors for the treatment of metabolic disorders PCSK9, PCSK7, PCSK6 HDAC1 530/4885HDAC2 2194/4885CHRM1 583/4885
US-11376260-B2 Serine/threonine kinase inhibitors MAP3K1, MAP3K4, MAP4K2 HDAC1 1035/4885HDAC2 1649/4885CHRM1 3401/4885
US-20210163410-A1 AN IMPROVED PROCESS FOR THE PREPARATION OF (2S)-2-[(4R)-2-OXO-4-PROPYLTETRAHYDRO-1H-PYRROL-1-YL] BUTANAMIDE AND ITS INTERMEDIATES THEREOF SCN1B, CACNA1B, CACNA1D HDAC1 519/4885HDAC2 517/4885CHRM1 745/4885
US-20150182537-A1 SERINE/THREONINE KINASE INHIBITORS MAP3K1, MAP3K4, MAP4K2 HDAC1 1035/4885HDAC2 1649/4885CHRM1 3401/4885
US-11813306-B2 Cyclic tetramer compounds as proprotein convertase subtilisin/kexin type 9 (PCSK9) inhibitors for the treatment of metabolic disorders PCSK9, PCSK7, PCSK6 HDAC1 530/4885HDAC2 2194/4885CHRM1 583/4885
US-20180000833-A1 SERINE/THREONINE KINASE INHIBITORS MAP3K1, MAP3K4, MAP4K2 HDAC1 1035/4885HDAC2 1649/4885CHRM1 3401/4885

“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.