SCHEMBL7775774

SCHEMBL7775774

C/C(=C/C=C/C(C)(C)O)c1cccc(OCc2cccc(C(O)O)c2)c1

nearest known ligand 0.43

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
VDR P11473 2/20 0.43
F2 P00734 6/20 0.43
MAOB P27338 7/20 0.42
MAOA P21397 1/20 0.41
NR4A1 P22736 1/20 0.38
NR4A2 P43354 1/20 0.38
NR4A3 Q92570 1/20 0.38

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
SCHEMBL2107509 0.90 F2 (0.44) VDRF2MAOBMAOANR4A1
SCHEMBL6155843 0.88 MRGPRX4 (0.46) F2MAOB
SCHEMBL6155497 0.81 VDR (0.46) VDRF2MAOBMAOANR4A1
SCHEMBL2801801 0.81 VDR (0.55) VDRF2MAOBMAOANR4A1
SCHEMBL2107505 0.81 VDR (0.66) VDRF2MAOBMAOANR4A1
SCHEMBL2107507 0.81 VDR (0.66) VDRF2MAOBMAOANR4A1
SCHEMBL6155837 0.79 VDR (0.55) VDRF2MAOB
SCHEMBL2781757 0.79 VDR (0.48) VDRMAOB
SCHEMBL6155848 0.79 VDR (0.55) VDRF2MAOB
SCHEMBL6155841 0.79 VDR (0.55) VDRF2MAOB

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-1124779-A1 VITAMIN D ANALOGUES Galderma Research & Development, S.N.C. (FR) 2001-08-22 EP disclosed
WO-2000026167-A1 VITAMIN D ANALOGUES GALDERMA RESEARCH & DEVELOPMENT, S.N.C. (FR) 2000-05-11 WO disclosed