SCHEMBL9823302

SCHEMBL9823302

COc1ccc(-c2nc(C(=O)O)c(C)s2)cc1

nearest known ligand 0.63

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PTGDR2 Q9Y5Y4 6/20 0.53
ALOX5 P09917 3/20 0.50
KDM4E B2RXH2 3/20 0.50
ALDH1A1 P00352 2/20 0.50
RAB9A P51151 2/20 0.50
NPC1 O15118 1/20 0.50
SMN1; SMN2 Q16637 1/20 0.50
HPGD P15428 1/20 0.48
GAA P10253 1/20 0.48
MAPT P10636 1/20 0.47

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
SCHEMBL18003674 0.87 KDM4E (0.57) PTGDR2ALOX5KDM4EALDH1A1RAB9A
SCHEMBL3417072 0.84 KDM4E (0.61) ALOX5KDM4EALDH1A1RAB9ANPC1
SCHEMBL5195843 0.84 PTGDR2 (0.52) PTGDR2ALOX5KDM4EALDH1A1RAB9A
SCHEMBL10552788 0.83 TARBP2 (0.57) KDM4EALDH1A1RAB9ANPC1HPGD
SCHEMBL3995172 0.82 RARA (0.60) ALOX5KDM4EALDH1A1NPC1SMN1; SMN2
SCHEMBL6503223 0.81 RARA (0.49) PTGDR2ALOX5KDM4ERAB9ANPC1
SCHEMBL6496085 0.81 KDM4E (0.63) PTGDR2KDM4EALDH1A1RAB9ANPC1
SCHEMBL3419091 0.80 RAB9A (0.74) PTGDR2ALOX5KDM4EALDH1A1RAB9A
SCHEMBL7898920 0.79 RARB (0.47) KDM4EALDH1A1RAB9ANPC1SMN1; SMN2
SCHEMBL13898561 0.78 PTGDR2 (0.56) PTGDR2ALOX5KDM4EALDH1A1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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