SCHEMBL7608523

SCHEMBL7608523

CCC(CCO)c1cc(C)c(-c2cccc(OCc3ccc(CO)c(CO)c3)c2)c(C)c1

nearest known ligand 0.41

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
VDR P11473 2/20 0.41
FFAR1 O14842 17/20 0.40
FFAR4 Q5NUL3 1/20 0.39

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
SCHEMBL7610502 0.88 VDR (0.42) VDRFFAR1FFAR4
SCHEMBL7606363 0.87 VDR (0.43) VDRFFAR1
SCHEMBL7611575 0.85 VDR (0.41) VDRFFAR1FFAR4
SCHEMBL7604643 0.85 VDR (0.42) VDRFFAR1FFAR4
SCHEMBL7608336 0.82 VDR (0.42) VDRFFAR1
SCHEMBL7605313 0.82 VDR (0.40) VDRFFAR1
SCHEMBL7608528 0.82 FFAR1 (0.43) VDRFFAR1FFAR4
SCHEMBL7613344 0.81 RXRA (0.34) VDRFFAR1
SCHEMBL7605392 0.81 FFAR1 (0.41) VDRFFAR1FFAR4
SCHEMBL7606369 0.80 FFAR1 (0.43) VDRFFAR1FFAR4

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-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