SCHEMBL6156001

SCHEMBL6156001

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

nearest known ligand 0.42

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
VDR P11473 1/20 0.41
NR4A1 P22736 1/20 0.40
NR4A2 P43354 1/20 0.40
NR4A3 Q92570 1/20 0.40
ALOX5 P09917 5/20 0.39
APP P05067 1/20 0.39
MAOB P27338 2/20 0.37
PKM P14618 1/20 0.37
PTPN2 P17706 1/20 0.37
PTPN1 P18031 1/20 0.37
PTPRB P23467 1/20 0.37
PTPN6 P29350 1/20 0.37
PTPN11 Q06124 1/20 0.37
SOD1 P00441 1/20 0.36

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
SCHEMBL6155445 0.86 NR4A1 (0.40) NR4A1NR4A2NR4A3ALOX5APP
SCHEMBL6155992 0.81 VDR (0.62) VDRNR4A1NR4A2NR4A3ALOX5
SCHEMBL6156005 0.81 VDR (0.62) VDRNR4A1NR4A2NR4A3ALOX5
SCHEMBL4169952 0.78 APP (0.40) NR4A1NR4A2NR4A3ALOX5APP
SCHEMBL2781453 0.78 VDR (0.40) VDRALOX5MAOB
SCHEMBL2801801 0.77 VDR (0.55) VDRNR4A1NR4A2NR4A3MAOB
SCHEMBL6154726 0.77 APP (0.39) NR4A1NR4A2NR4A3ALOX5APP
SCHEMBL6156481 0.76 MAOB (0.39) NR4A1NR4A2NR4A3ALOX5APP
SCHEMBL2781788 0.76 VDR (0.70) VDRNR4A1NR4A2NR4A3MAOB
SCHEMBL6156388 0.76 ALOX5 (0.39) NR4A1NR4A2NR4A3ALOX5MAOB

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 6 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-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