SCHEMBL7605149

SCHEMBL7605149

CCC(CCO)c1ccc(-c2cccc(OCc3ccc(CO)c(CO)c3)c2)c(C(C)(C)C)c1

nearest known ligand 0.53

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 14/20 0.53
VDR P11473 3/20 0.42
NR1H2 P55055 2/20 0.34
NR1H3 Q13133 2/20 0.34

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) FFAR1VDR
SCHEMBL6566520 0.85 FFAR1 (0.47) FFAR1VDRNR1H2NR1H3
SCHEMBL7647330 0.85 FFAR1 (0.44) FFAR1VDR
SCHEMBL7606363 0.85 VDR (0.43) FFAR1VDR
SCHEMBL7605154 0.83 FFAR1 (0.50) FFAR1VDRNR1H2NR1H3
SCHEMBL7607682 0.82 VDR (0.44) FFAR1VDR
SCHEMBL7605392 0.81 FFAR1 (0.41) FFAR1VDR
SCHEMBL7605313 0.80 VDR (0.40) FFAR1VDR
SCHEMBL7606369 0.80 FFAR1 (0.43) FFAR1VDR
SCHEMBL7608336 0.80 VDR (0.42) FFAR1VDR

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