SCHEMBL7765823

SCHEMBL7765823

CC(C)C[C@@H](C(=O)O)C(Cc1ccccc1CNC(=O)OCc1ccccc1)C(=O)OC(C)(C)C

nearest known ligand 0.50

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
KCNA5 P22460 7/20 0.50
SYK P43405 1/20 0.44
CTSK P43235 2/20 0.44
HSD17B10 Q99714 1/20 0.42
POLB P06746 1/20 0.42
GPR55 Q9Y2T6 1/20 0.42

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
SCHEMBL7765812 1.00 KCNA5 (0.50) KCNA5SYKCTSKHSD17B10POLB
SCHEMBL7759200 0.89 POLB (0.49) KCNA5SYKCTSKPOLBGPR55
SCHEMBL7759196 0.89 POLB (0.49) KCNA5SYKCTSKPOLBGPR55
SCHEMBL7762867 0.89 KCNA5 (0.47) KCNA5SYKCTSKHSD17B10POLB
SCHEMBL7762862 0.89 KCNA5 (0.47) KCNA5SYKCTSKHSD17B10POLB
SCHEMBL7763743 0.87 SYK (0.44) KCNA5SYKCTSKHSD17B10POLB
SCHEMBL7763739 0.87 SYK (0.44) KCNA5SYKCTSKHSD17B10POLB
SCHEMBL5679927 0.82 MAPT (0.52) SYKCTSK
SCHEMBL7762013 0.82 POLB (0.46) KCNA5SYKCTSKPOLBGPR55
SCHEMBL7762011 0.82 POLB (0.46) KCNA5SYKCTSKPOLBGPR55

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1101492-A1 NOVEL REMEDIES FOR ALLERGIC DISEASES FUJI YAKUHIN KOGYO KABUSHIKI KAISHA (JP) 2001-05-23 EP disclosed
EP-1038864-A1 NOVEL METALLOPROTEINASE INHIBITORS FUJI YAKUHIN KOGYO KABUSHIKI KAISHA (JP) 2000-09-27 EP disclosed