SCHEMBL7612427

SCHEMBL7612427

CCC(O)CCc1ccc(-c2cccc(OCc3ccc(CO)c(CO)c3)c2C)cc1

nearest known ligand 0.40

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CD274 Q9NZQ7 17/20 0.40
PDCD1 Q15116 5/20 0.40
FFAR4 Q5NUL3 1/20 0.36
FFAR1 O14842 1/20 0.35

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
SCHEMBL7606753 0.89 VDR (0.35) CD274PDCD1FFAR4FFAR1
SCHEMBL7604546 0.82 CD274 (0.40) CD274PDCD1
SCHEMBL7612422 0.82 CD274 (0.40) CD274PDCD1
SCHEMBL7606366 0.81 VDR (0.44) FFAR4FFAR1
SCHEMBL7610930 0.80 VDR (0.45) FFAR4FFAR1
SCHEMBL6564914 0.79 VDR (0.50) CD274PDCD1
SCHEMBL7610506 0.78 VDR (0.43) FFAR4FFAR1
SCHEMBL7610505 0.77 VDR (0.43) CD274FFAR4FFAR1
SCHEMBL7606742 0.77 VDR (0.35) CD274PDCD1FFAR4FFAR1
SCHEMBL7604645 0.76 VDR (0.42) FFAR4FFAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1235777-A2 VITAMIN D ANALOGUES Galderma Research & Development, S.N.C. (FR) 2002-09-04 EP claimed
WO-2001038303-A2 VITAMIN D ANALOGUES GALDERMA RESEARCH & DEVELOPMENT, S.N.C. (FR) 2001-05-31 WO claimed
EP-1235777-A2 VITAMIN D ANALOGUES Galderma Research & Development, S.N.C. (FR) 2002-09-04 EP disclosed
WO-2001038303-A2 VITAMIN D ANALOGUES GALDERMA RESEARCH & DEVELOPMENT, S.N.C. (FR) 2001-05-31 WO disclosed