SCHEMBL6882116

SCHEMBL6882116

CCC(O)(CC)c1ccc(-c2cccc(OCc3ccc(CO)c(CO)c3)c2)cc1C.CCC(O)c1ccc(-c2cccc(COc3ccc(CO)c(CO)c3)c2)c(C)c1

nearest known ligand 0.41

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
VDR P11473 3/20 0.41
FFAR1 O14842 16/20 0.37
FFAR4 Q5NUL3 2/20 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
SCHEMBL6566288 0.86 FFAR1 (0.45) FFAR1FFAR4
SCHEMBL6882117 0.85 VDR (0.43) VDRFFAR1FFAR4
SCHEMBL6564194 0.84 VDR (0.50) VDRFFAR1
SCHEMBL7608281 0.79 FFAR1 (0.43) FFAR1FFAR4
SCHEMBL7611585 0.79 VDR (0.42) VDRFFAR1FFAR4
SCHEMBL6562865 0.78 VDR (0.61) VDRFFAR1FFAR4
SCHEMBL6563025 0.78 VDR (0.58) VDRFFAR1FFAR4
SCHEMBL6565081 0.77 VDR (0.43) VDRFFAR1FFAR4
SCHEMBL6566235 0.76 VDR (0.43) VDRFFAR1FFAR4
SCHEMBL7606369 0.75 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6831106-B1 Selective activity on cell proliferation and differentiation without displaying any hypercalcaemiant nature GALDERMA RESEARCH & DEVELOPMENT, S.N.C. (FR) 2004-12-14 US claimed