SCHEMBL6155253

SCHEMBL6155253

CCC(=CCCC(O)(C(F)(F)F)C(F)(F)F)c1cccc(OCc2ccc(C(O)O)cc2)c1

nearest known ligand 0.47

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
VDR P11473 2/20 0.47
MAOB P27338 7/20 0.42
NR4A2 P43354 3/20 0.38
NR4A1 P22736 1/20 0.38
NR4A3 Q92570 1/20 0.38
F2 P00734 2/20 0.38
MAOA P21397 2/20 0.37
SMPD1 P17405 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
SCHEMBL6156762 0.89 VDR (0.45) VDRMAOBNR4A2NR4A1NR4A3
SCHEMBL6154679 0.88 VDR (0.46) VDRMAOBNR4A2NR4A1NR4A3
SCHEMBL6155091 0.83 VDR (0.68) VDRMAOBNR4A2NR4A1NR4A3
SCHEMBL6155086 0.83 VDR (0.68) VDRMAOBNR4A2NR4A1NR4A3
SCHEMBL6155255 0.83 VDR (0.68) VDRMAOBNR4A2NR4A1NR4A3
SCHEMBL6155595 0.82 VDR (0.45) VDRMAOBNR4A2NR4A1NR4A3
SCHEMBL6156524 0.81 NR4A1 (0.41) VDRMAOBNR4A2NR4A1NR4A3
SCHEMBL6157101 0.80 VDR (0.41) VDRMAOBNR4A2NR4A1NR4A3
SCHEMBL3280129 0.80 VDR (0.72) VDRMAOBNR4A2NR4A1NR4A3
SCHEMBL3280116 0.80 VDR (0.47) VDRMAOBNR4A2NR4A1NR4A3

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