SCHEMBL9922254

SCHEMBL9922254

COc1ccc2c(c1)C(=O)N(C)C(=O)C2

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.63
HPGD P15428 3/20 0.63
GAA P10253 3/20 0.63
KDM4E B2RXH2 1/20 0.63
CYP1A2 P05177 1/20 0.63
CYP3A4 P08684 1/20 0.63
CYP2C9 P11712 1/20 0.63
CYP2C19 P33261 1/20 0.63
L3MBTL1 Q9Y468 1/20 0.63
KMT2A Q03164 4/20 0.62
MEN1 O00255 3/20 0.62
SMN1; SMN2 Q16637 1/20 0.62
CASP1 P29466 1/20 0.59
METAP1 P53582 2/20 0.54
HTR2A P28223 1/20 0.48
HTR2C P28335 1/20 0.48
HTR2B P41595 1/20 0.48
ACHE P22303 1/20 0.46
PDE3B Q13370 1/20 0.45
PDE3A Q14432 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
SCHEMBL9922257 0.90 METAP1 (0.55) ALDH1A1HPGDGAAKDM4ECYP1A2
SCHEMBL13495344 0.83 ALDH1A1 (0.62) ALDH1A1HPGDGAAKDM4ECYP1A2
SCHEMBL23926949 0.81 KDM4E (0.48) ALDH1A1HPGDGAAKDM4ECYP1A2
SCHEMBL6074566 0.80 HTT (0.53) ALDH1A1HPGDGAAKDM4ECYP1A2
SCHEMBL29853451 0.78 METAP1 (0.53) ALDH1A1HPGDGAAKDM4ECYP1A2
SCHEMBL26768760 0.78 METAP1 (0.53) ALDH1A1HPGDGAAKDM4ECYP1A2
SCHEMBL8343209 0.78 METAP1 (0.50) ALDH1A1HPGDGAAKDM4ECYP1A2
SCHEMBL578369 0.77 LMNA (0.60) ALDH1A1HPGDGAACYP1A2KMT2A
SCHEMBL7934255 0.77 ALDH1A1 (0.51) ALDH1A1HPGDGAAKDM4ECYP1A2
SCHEMBL9390048 0.77 CASP6 (0.44) GAAKMT2AMEN1METAP1HTR2A

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 20 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220048887-A1 IMPURITIES OF AMIDE-LIKE DERIVATIVES AND USE THEREOF NHWA PHARMA. CORPORATION (CN) 2022-02-17 US disclosed
US-20220048887-A1 IMPURITIES OF AMIDE-LIKE DERIVATIVES AND USE THEREOF NHWA PHARMA. CORPORATION (CN) 2022-02-17 US disclosed
EP-3901149-A1 IMPURITIES OF AMIDE DERIVATIVES AND USE THEREOF NHWA Pharma Corporation (CN) 2021-10-27 EP disclosed
EP-3901149-A1 IMPURITIES OF AMIDE DERIVATIVES AND USE THEREOF NHWA Pharma Corporation (CN) 2021-10-27 EP disclosed
CN-113195486-A Impurities of amide derivatives and application thereof 江苏恩华药业股份有限公司 2021-07-30 CN disclosed
WO-2020125580-A1 IMPURITIES OF AMIDE DERIVATIVES AND USE THEREOF 江苏恩华药业股份有限公司 2020-06-25 WO disclosed
WO-2020125580-A1 IMPURITIES OF AMIDE DERIVATIVES AND USE THEREOF 江苏恩华药业股份有限公司 2020-06-25 WO disclosed
CN-111320619-A Impurities of amide-like derivatives and application 江苏恩华药业股份有限公司 2020-06-23 CN disclosed
US-8524721-B2 Platelet ADP receptor inhibitors PORTOLA PHARMACEUTICALS, INC. (US) 2013-09-03 US disclosed
US-20120149688-A1 PLATELET ADP RECEPTOR INHIBITORS PORTOLA PHARMACEUTICALS, INC. (US) 2012-06-14 US disclosed
US-8067428-B2 Platelet ADP receptor inhibitors PORTOLA PHARMACEUTICALS, INC. (US) 2011-11-29 US disclosed
US-8067428-B2 Platelet ADP receptor inhibitors PORTOLA PHARMACEUTICALS, INC. (US) 2011-11-29 US disclosed
US-20100234350-A1 PLATELET ADP RECEPTOR INHIBITORS PORTOLA PHARMACEUTICALS, INC. (US) 2010-09-16 US disclosed
US-20100234350-A1 PLATELET ADP RECEPTOR INHIBITORS PORTOLA PHARMACEUTICALS, INC. (US) 2010-09-16 US disclosed
US-7622474-B2 Asulfonyl(urea, thiourea, guanidine, cyanoguanidine) compounds; cardiovascular disorders; thrombosis PORTOLA PHARMACEUTICALS, INC. (US) 2009-11-24 US disclosed
US-7622474-B2 Asulfonyl(urea, thiourea, guanidine, cyanoguanidine) compounds; cardiovascular disorders; thrombosis PORTOLA PHARMACEUTICALS, INC. (US) 2009-11-24 US disclosed
US-20080194597-A1 Asulfonyl(urea, thiourea, guanidine, cyanoguanidine) compounds; cardiovascular disorders; thrombosis PORTOLA PHARMACEUTICALS, INC. (US) 2008-08-14 US disclosed
US-20080194597-A1 Asulfonyl(urea, thiourea, guanidine, cyanoguanidine) compounds; cardiovascular disorders; thrombosis PORTOLA PHARMACEUTICALS, INC. (US) 2008-08-14 US disclosed
US-7358257-B2 sulfonylurea derivatives, sulfonylthiourea derivatives, sulfonylguanidine derivatives, sulfonylcyanoguanidine derivatives, thioacylsulfonamide derivatives, and acylsulfonamide derivatives; effective for prevention and treatment of cardiovascular diseases, antithrombotic agents PORTOLA PHARMACEUTICALS, INC. (US) 2008-04-15 US disclosed
US-7358257-B2 sulfonylurea derivatives, sulfonylthiourea derivatives, sulfonylguanidine derivatives, sulfonylcyanoguanidine derivatives, thioacylsulfonamide derivatives, and acylsulfonamide derivatives; effective for prevention and treatment of cardiovascular diseases, antithrombotic agents PORTOLA PHARMACEUTICALS, INC. (US) 2008-04-15 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 (4 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-20100234350-A1 PLATELET ADP RECEPTOR INHIBITORS TBXA2R, GP6, P2RY6 ALDH1A1 1369/4885HPGD 1774/4885GAA 2005/4885
US-20080194597-A1 Asulfonyl(urea, thiourea, guanidine, cyanoguanidine) compounds; cardiovascular disorders; thrombosis PIGS, GP6, ASGR1 ALDH1A1 1520/4885HPGD 1617/4885GAA 760/4885
US-20120149688-A1 PLATELET ADP RECEPTOR INHIBITORS TBXA2R, GP6, P2RY6 ALDH1A1 1379/4885HPGD 1763/4885GAA 1991/4885
US-20220048887-A1 IMPURITIES OF AMIDE-LIKE DERIVATIVES AND USE THEREOF NOTUM, CYP51A1, HADHB ALDH1A1 339/4885HPGD 755/4885GAA 101/4885

“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.