SCHEMBL10969986

SCHEMBL10969986

Cc1ccc2[nH]c(=O)c(C(=O)O)cc2c1

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 8/20 0.66
ALDH1A1 P00352 7/20 0.66
GAA P10253 3/20 0.66
POLB P06746 3/20 0.66
PIN1 Q13526 1/20 0.63
DAO P14920 1/20 0.63
HSD17B10 Q99714 6/20 0.57
HPGD P15428 5/20 0.50
CA12 O43570 2/20 0.50
CA9 Q16790 2/20 0.50
CA1 P00915 1/20 0.50
CA2 P00918 1/20 0.50
CA4 P22748 1/20 0.50
CA6 P23280 1/20 0.50
MAOB P27338 1/20 0.50
CA5A P35218 1/20 0.50
CA7 P43166 1/20 0.50
CA14 Q9ULX7 1/20 0.50
CA5B Q9Y2D0 1/20 0.50
MAPT P10636 1/20 0.49

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
SCHEMBL1366351 0.88 DAO (0.65) KDM4EALDH1A1GAAPOLBPIN1
SCHEMBL10330642 0.87 DAO (0.63) KDM4EALDH1A1GAAPOLBPIN1
SCHEMBL22223088 0.83 DAO (0.58) KDM4EALDH1A1GAAPOLBPIN1
SCHEMBL12082628 0.83 ALDH1A1 (0.61) KDM4EALDH1A1GAAPOLBPIN1
SCHEMBL15564491 0.82 DAO (0.54) KDM4EALDH1A1GAAPOLBPIN1
SCHEMBL2806050 0.81 KDM4E (0.63) KDM4EALDH1A1GAAPOLBHSD17B10
SCHEMBL29415468 0.81 KDM4E (0.63) KDM4EALDH1A1GAAPOLBHSD17B10
SCHEMBL4649667 0.81 DAO (0.52) KDM4EALDH1A1GAAPOLBPIN1
SCHEMBL8500109 0.80 KDM4E (0.63) KDM4EALDH1A1GAAPOLBDAO
SCHEMBL2310250 0.80 F7 (0.63) KDM4EALDH1A1GAAPOLBDAO

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-0073507-B1 SULFONYL UREAS, PROCESS FOR THEIR PREPARATION, PHARMACEUTICAL COMPOSITIONS CONTAINING THEM AND THEIR USE HOECHST AKTIENGESELLSCHAFT (DE) 1985-10-16 EP disclosed
US-4542139-A HYPOGLYCEMIC AGENTS HOECHST AKTIENGESELLSCHAFT (DE) 1985-09-17 US disclosed
EP-0073507-A1 Sulfonyl ureas, process for their preparation, pharmaceutical compositions containing them and their use HOECHST AKTIENGESELLSCHAFT (DE) 1983-03-09 EP disclosed