SCHEMBL6155757

SCHEMBL6155757

CC(=CC=CC(C)(C)O)c1cccc(OCc2ccc(CO[Si](C)(C)C(C)(C)C)c(CO[Si](C)(C)C(C)(C)C)c2)c1

nearest known ligand 0.48

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
VDR P11473 2/20 0.48
MAOB P27338 12/20 0.39
MAOA P21397 4/20 0.38
F2 P00734 5/20 0.37
NR4A1 P22736 1/20 0.37
NR4A2 P43354 1/20 0.37
NR4A3 Q92570 1/20 0.37

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
SCHEMBL6885664 0.93 VDR (0.40) VDRMAOBF2
SCHEMBL6885661 0.93 VDR (0.40) VDRMAOBF2
SCHEMBL6156248 0.93 VDR (0.40) VDRMAOBF2
SCHEMBL6886918 0.87 VDR (0.41) VDR
SCHEMBL6886921 0.87 VDR (0.41) VDR
SCHEMBL6158573 0.87 VDR (0.41) VDR
SCHEMBL6881384 0.85 VDR (0.49) VDRMAOBF2
SCHEMBL6881388 0.85 VDR (0.49) VDRMAOBF2
SCHEMBL6154751 0.85 VDR (0.49) VDRMAOBF2
SCHEMBL2107505 0.84 VDR (0.66) VDRMAOBMAOAF2NR4A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1124779-B1 VITAMIN D ANALOGUES GALDERMA RES & DEV (FR) 2005-02-02 EP disclosed
US-6689922-B1 BIAROMATIC COMPOUNDS WHICH ARE ANALOGUES OF VITAMIN D HAVE A MARKED ACTIVITY IN THE FIELDS OF CELL DIFFERENTIATION AND PROLIFERATION GALDERMA RESEARCH & DEVELOPMENT S.N.C. (FR) 2004-02-10 US disclosed
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