SCHEMBL6506142

SCHEMBL6506142

Cc1ccc(-c2nc(C(=O)O)c(C)s2)s1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DAO P14920 1/20 0.44
MEN1 O00255 3/20 0.40
KMT2A Q03164 3/20 0.40
NPC1 O15118 3/20 0.40
RXFP1 Q9HBX9 2/20 0.40
KDM4E B2RXH2 2/20 0.39
PTGER1 P34995 1/20 0.38
RARA P10276 1/20 0.38
RARB P10826 1/20 0.38
RARG P13631 1/20 0.38
ALDH1A1 P00352 3/20 0.37
MAPT P10636 2/20 0.37
SMN1; SMN2 Q16637 2/20 0.37
CYP1A2 P05177 1/20 0.37
CYP2C9 P11712 1/20 0.37
CYP2C19 P33261 1/20 0.37
GFER P55789 1/20 0.36
HSD17B10 Q99714 1/20 0.36
GABRP O00591 1/20 0.36
GABRD O14764 1/20 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
SCHEMBL6498884 0.85 DAO (0.44) DAOMEN1KMT2ANPC1RXFP1
SCHEMBL9823754 0.80 KMT2A (0.49) MEN1KMT2ANPC1KDM4ERARA
SCHEMBL6496780 0.79 KDM4E (0.64) KMT2ANPC1RXFP1KDM4EALDH1A1
SCHEMBL3995172 0.77 RARA (0.60) MEN1KMT2ANPC1KDM4EPTGER1
SCHEMBL3417072 0.76 KDM4E (0.61) MEN1KMT2ANPC1KDM4ERARA
SCHEMBL17066355 0.74 ALDH1A1 (0.42) MEN1KMT2ANPC1KDM4EALDH1A1
SCHEMBL6503223 0.73 RARA (0.49) NPC1KDM4ERARARARBRARG
SCHEMBL289699 0.73 KDM4E (0.61) KMT2ANPC1KDM4EALDH1A1MAPT
SCHEMBL6505414 0.73 HPGD (0.47) MEN1KMT2ANPC1KDM4EPTGER1
SCHEMBL6496085 0.73 KDM4E (0.63) MEN1KMT2ANPC1KDM4ERARA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1228327-C Carboxylic acid derivatives and drugs containing the same EISAI CO LTD (JP) 2005-11-23 CN disclosed
US-6884821-B1 Carboxylic acid derivatives and drugs containing the same EISAI CO., LTD. (JP) 2005-04-26 US disclosed
CN-1377336-A Carboxylic acid derivatives and drugs containing the same EISAI CO LTD (JP) 2002-10-30 CN disclosed
EP-1216980-A1 CARBOXYLIC ACID DERIVATIVES AND DRUGS CONTAINING THE SAME Eisai Co., Ltd. (JP) 2002-06-26 EP disclosed
EP-0262873-B1 N-TETRAZOLYL THIAZOLECARBOXAMIDE DERIVATIVES AND THEIR USE SAWAI PHARMACEUTICAL CO., LTD. (JP) 1991-08-21 EP disclosed
US-4879295-A ANTIALLERGENS SAWAI PHARMACEUTICAL CO., LTD. (JP) 1989-11-07 US disclosed
EP-0262873-A1 N-tetrazolyl thiazolecarboxamide derivatives and their use SAWAI PHARMACEUTICAL CO., LTD. (JP) 1988-04-06 EP disclosed