SCHEMBL6155595

SCHEMBL6155595

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

nearest known ligand 0.45

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
VDR P11473 2/20 0.45
MAOB P27338 7/20 0.42
SMPD1 P17405 1/20 0.39
NR4A2 P43354 2/20 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

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
SCHEMBL6155600 0.83 VDR (0.66) VDRMAOBNR4A2NR4A1NR4A3
SCHEMBL6155590 0.83 VDR (0.66) VDRMAOBNR4A2NR4A1NR4A3
SCHEMBL6155586 0.83 VDR (0.66) VDRMAOBNR4A2NR4A1NR4A3
SCHEMBL6155253 0.82 VDR (0.47) VDRMAOBSMPD1NR4A2NR4A1
SCHEMBL6154679 0.82 VDR (0.46) VDRMAOBSMPD1NR4A2NR4A1
SCHEMBL6156101 0.81 VDR (0.48) VDRMAOBSMPD1NR4A2NR4A1
SCHEMBL6156762 0.81 VDR (0.45) VDRMAOBSMPD1NR4A2NR4A1
SCHEMBL2781788 0.79 VDR (0.70) VDRMAOBSMPD1NR4A2NR4A1
SCHEMBL6155866 0.79 MAOB (0.43) VDRMAOBSMPD1NR4A2NR4A1
SCHEMBL3280129 0.78 VDR (0.72) VDRMAOBSMPD1NR4A2NR4A1

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 8 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
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