SCHEMBL4399775

SCHEMBL4399775

CCC(=CCO)c1cccc(CCc2ccc(C(C)(C)O[SiH2]C(C)(C)C)c(C(C)(C)O[SiH2]C(C)(C)C)c2)c1

nearest known ligand 0.38

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
VDR P11473 3/20 0.38
CYP4F2 P78329 2/20 0.31
CYP4A11 Q02928 2/20 0.31

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
SCHEMBL4407512 0.86 VDR (0.36) VDR
SCHEMBL4407806 0.86 VDR (0.40) VDRCYP4F2CYP4A11
SCHEMBL4410313 0.85 VDR (0.39) VDR
SCHEMBL3280119 0.85 PDPK1 (0.36) VDRCYP4F2CYP4A11
SCHEMBL4405455 0.82 CYP4F2 (0.36) CYP4F2CYP4A11
SCHEMBL3280514 0.82 VDR (0.41) VDRCYP4F2CYP4A11
SCHEMBL6566330 0.82
SCHEMBL4399869 0.81 VDR (0.40) VDR
SCHEMBL3280260 0.81 VDR (0.62) VDR
SCHEMBL6156234 0.80 MAOB (0.39) CYP4F2CYP4A11

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1395538-B1 VITAMIN D ANALOGUES GALDERMA RES & DEV (FR) 2009-12-30 EP disclosed
EP-1395538-A1 VITAMIN D ANALOGUES Galderma Research & Development, S.N.C. (FR) 2004-03-10 EP disclosed
WO-2002094754-A1 VITAMIN D ANALOGUES GALDERMA RESEARCH & DEVELOPMENT, S.N.C. (FR) 2002-11-28 WO disclosed