SCHEMBL1463003

SCHEMBL1463003

Cc1csc(C=CC(=O)O)c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HCAR2 Q8TDS4 3/20 0.47
DAO P14920 2/20 0.47
ALDH1A1 P00352 6/20 0.43
SMN1; SMN2 Q16637 3/20 0.43
MAPK1 P28482 3/20 0.42
KMT2A Q03164 2/20 0.42
EIF2AK2 P19525 1/20 0.38
CSNK2A2 P19784 1/20 0.38
CSNK2B P67870 1/20 0.38
CSNK2A1 P68400 1/20 0.38
ESR1 P03372 2/20 0.37
HDAC3 O15379 2/20 0.36
HDAC4 P56524 2/20 0.36
HDAC1 Q13547 2/20 0.36
HDAC7 Q8WUI4 2/20 0.36
HDAC2 Q92769 2/20 0.36
HDAC10 Q969S8 2/20 0.36
HDAC11 Q96DB2 2/20 0.36
HDAC8 Q9BY41 2/20 0.36
HDAC6 Q9UBN7 2/20 0.36

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
SCHEMBL1463002 1.00 HCAR2 (0.47) HCAR2DAOALDH1A1SMN1; SMN2MAPK1
SCHEMBL13305777 0.85 DAO (0.42) HCAR2DAOALDH1A1SMN1; SMN2MAPK1
SCHEMBL8948187 0.85 DAO (0.42) HCAR2DAOALDH1A1SMN1; SMN2MAPK1
SCHEMBL609542 0.81 JUN (0.54) HCAR2DAOALDH1A1SMN1; SMN2HDAC1
SCHEMBL5204964 0.81 HCAR2 (0.45) HCAR2ALDH1A1SMN1; SMN2MAPK1KMT2A
SCHEMBL5204967 0.81 HCAR2 (0.45) HCAR2ALDH1A1SMN1; SMN2MAPK1KMT2A
SCHEMBL8987306 0.80 MAPT (0.55) ALDH1A1SMN1; SMN2KMT2AHPGDLMNA
SCHEMBL18639716 0.79 DAO (0.38) HCAR2DAOHDAC3HDAC4HDAC1
SCHEMBL18874102 0.79 DAO (0.39) DAOLMNAPTGS1PTGS2ALOX5
SCHEMBL380483 0.78 HCAR2 (0.48) HCAR2ALDH1A1MAPK1KMT2AEIF2AK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118165002-A Polycyclic compounds and methods of use thereof 桑诺维恩药品公司 2024-06-11 CN disclosed
EP-3252057-B1 MULTICYCLIC COMPOUNDS AND METHODS OF USE THEREOF SUNOVION PHARMACEUTICALS INC (US) 2024-03-27 EP disclosed
US-20220387382-A1 MULTICYCLIC COMPOUNDS AND METHODS OF USE THEREOF SUNOVION PHARMACEUTICALS INC. (US) 2022-12-08 US disclosed
US-10894033-B2 Multicyclic compounds and methods of use thereof SUNOVION PHARMACEUTICALS INC. (US) 2021-01-19 US disclosed
US-20200323819-A1 MULTICYCLIC COMPOUNDS AND METHODS OF USE THEREOF SUNOVION PHARMACEUTICALS INC. (US) 2020-10-15 US disclosed
CN-111560025-A Polycyclic compounds and methods of use thereof 桑诺维恩药品公司 2020-08-21 CN disclosed
CN-106883246-B Polycyclic compounds and methods of use thereof 桑诺维恩药品公司 2020-05-29 CN disclosed
US-20190125722-A1 MULTICYCLIC COMPOUNDS AND METHODS OF USE THEREOF SUNOVION PHARMACEUTICALS INC. (US) 2019-05-02 US disclosed
US-10085968-B2 Multicyclic compounds and methods of use thereof SUNOVION PHARMACEUTICALS INC. (US) 2018-10-02 US disclosed
EP-3252057-A2 MULTICYCLIC COMPOUNDS AND METHODS OF USE THEREOF Sunovion Pharmaceuticals Inc. (US) 2017-12-06 EP disclosed
US-20070060607-A1 4-amino-thieno[3,2-c] pyridine-7-carboxylic acid derivatives BARTKOVITZ DAVID J 2007-03-15 US disclosed
WO-2007019884-A1 NOVEL 4-AMINO-THIENO[3,2-C]PYRIDINE-7-CARBOXYLIC ACID AMIDES F. HOFFMANN-LA ROCHE AG (CH) 2007-02-22 WO disclosed
WO-2007001335-A2 RAMOPLANIN DERIVATIVES POSSESSING ANTIBACTERIAL ACTIVITY VICURON PHARMACEUTICALS INC. (US) 2007-01-04 WO disclosed
US-20060211603-A1 Ramoplanin derivatives possessing antibacterial activity VICURON PHARMACEUTICALS INC. (US) 2006-09-21 US disclosed
EP-1556053-A4 ANTIINFLAMMATION AGENTS AMGEN INC (US) 2006-04-19 EP disclosed
US-20050256154-A1 4-Amino-thieno[3,2-c]pyridine-7-carboxylic acid amides LUK KIN-CHUN 2005-11-17 US disclosed
EP-1556053-A1 ANTIINFLAMMATION AGENTS Amgen Inc. (US) 2005-07-27 EP disclosed
WO-2004041285-A1 ANTIINFLAMMATION AGENTS AMGEN INC. (US) 2004-05-21 WO disclosed
US-20040097485-A1 Antiinflammation agents TULARIK INC. 2004-05-20 US disclosed
US-4948796-A TREATING CEREBO-VASCULARE DISEASES TOYAMA CHEMICAL CO., LTD. (JP) 1990-08-14 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 (9 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-20190125722-A1 MULTICYCLIC COMPOUNDS AND METHODS OF USE THEREOF GRIN2C, NLN, COMT HCAR2 810/4885DAO 1113/4885ALDH1A1 919/4885
US-20220387382-A1 MULTICYCLIC COMPOUNDS AND METHODS OF USE THEREOF GRIN2C, NLN, COMT HCAR2 810/4885DAO 1113/4885ALDH1A1 919/4885
US-20200323819-A1 MULTICYCLIC COMPOUNDS AND METHODS OF USE THEREOF GRIN2C, NLN, COMT HCAR2 810/4885DAO 1113/4885ALDH1A1 919/4885
US-20050256154-A1 4-Amino-thieno[3,2-c]pyridine-7-carboxylic acid amides FGFR3, FGFR4, FGFR1 HCAR2 389/4885DAO 1844/4885ALDH1A1 364/4885
US-20070060607-A1 4-amino-thieno[3,2-c] pyridine-7-carboxylic acid derivatives BRAF, RAF1, MAP3K7 HCAR2 1095/4885DAO 1687/4885ALDH1A1 933/4885
US-10894033-B2 Multicyclic compounds and methods of use thereof GRIN2C, NLN, COMT HCAR2 810/4885DAO 1113/4885ALDH1A1 919/4885
US-10085968-B2 Multicyclic compounds and methods of use thereof GRIN2A, AVPR1A, GRIN2C HCAR2 787/4885DAO 1971/4885ALDH1A1 919/4885
US-20060211603-A1 Ramoplanin derivatives possessing antibacterial activity CLSPN, LMAN2, RPN2 HCAR2 3637/4885DAO 1438/4885ALDH1A1 2972/4885
US-20040097485-A1 Antiinflammation agents TNF, NFATC1, NFKBIA HCAR2 119/4885DAO 1444/4885ALDH1A1 3037/4885

“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.