SCHEMBL7014647

SCHEMBL7014647

COc1c(F)c(F)cc(F)c1C(=O)O

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.44
KMT2A Q03164 4/20 0.44
HSD17B10 Q99714 2/20 0.43
KDM4E B2RXH2 1/20 0.43
ALDH1A1 P00352 1/20 0.43
CYP2C9 P11712 2/20 0.41
CYP1A2 P05177 1/20 0.41
CA1 P00915 3/20 0.41
CA2 P00918 3/20 0.41
CA4 P22748 2/20 0.41
LMNA P02545 1/20 0.41
MAPK1 P28482 1/20 0.41
HTT P42858 1/20 0.41
RAB9A P51151 1/20 0.41
GFER P55789 2/20 0.40
TSHR P16473 2/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
MAPT P10636 1/20 0.40
CA12 O43570 1/20 0.38
CA7 P43166 1/20 0.38

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
SCHEMBL203637 0.85 MEN1 (0.44) MEN1KMT2AHSD17B10KDM4EALDH1A1
SCHEMBL29411714 0.85 MEN1 (0.44) MEN1KMT2AHSD17B10KDM4EALDH1A1
SCHEMBL7763657 0.85 CA1 (0.45) MEN1KMT2AHSD17B10KDM4EALDH1A1
SCHEMBL12470332 0.82 MEN1 (0.40) MEN1KMT2AHSD17B10KDM4EALDH1A1
SCHEMBL24558316 0.80 ALDH1A1 (0.56) MEN1KMT2AHSD17B10KDM4EALDH1A1
SCHEMBL607945 0.77 HSD17B10 (0.44) MEN1KMT2AHSD17B10KDM4EALDH1A1
SCHEMBL29133142 0.77 HSD17B10 (0.49) MEN1KMT2AHSD17B10KDM4EALDH1A1
SCHEMBL448336 0.76 ALDH1A1 (0.39) MEN1KMT2AHSD17B10KDM4EALDH1A1
SCHEMBL12470199 0.76 KDM4E (0.50) MEN1KMT2AHSD17B10KDM4EALDH1A1
SCHEMBL27927680 0.76 HSD17B10 (0.43) MEN1KMT2AHSD17B10KDM4EALDH1A1

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-0945435-B1 NOVEL PYRIDONECARBOXYLIC ACID DERIVATIVES OR SALTS THEREOF AND DRUGS CONTAINING THE SAME AS THE ACTIVE INGREDIENT WAKUNAGA PHARMA CO LTD (JP) 2003-08-13 EP disclosed
US-6136823-A BACTERICIDES OR VIRICIDES WAKUNAGA PHARMACEUTICAL CO., LTD. (JP) 2000-10-24 US disclosed
EP-0945435-A1 NOVEL PYRIDONECARBOXYLIC ACID DERIVATIVES OR SALTS THEREOF AND DRUGS CONTAINING THE SAME AS THE ACTIVE INGREDIENT WAKUNAGA PHARMACEUTICAL CO., LTD. (JP) 1999-09-29 EP disclosed