SCHEMBL6155289

SCHEMBL6155289

CCN(CCCC(C)(C)O)c1cccc(OCc2ccc(CO)c(CO)c2)c1

nearest known ligand 0.46

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
VDR P11473 3/20 0.46
APP P05067 1/20 0.37
BCHE P06276 1/20 0.36
KDM4E B2RXH2 1/20 0.35
MEN1 O00255 1/20 0.35
ALDH1A1 P00352 1/20 0.35
THRB P10828 1/20 0.35
KMT2A Q03164 1/20 0.35
BCL2 P10415 2/20 0.35
NOS1 P29475 1/20 0.35
NOS2 P35228 1/20 0.35
MAOB P27338 4/20 0.34
CETP P11597 1/20 0.34
ALOX5 P09917 1/20 0.34

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
SCHEMBL6155831 0.88 VDR (0.46) VDRAPPBCL2NOS1NOS2
SCHEMBL6155485 0.84 VDR (0.45) VDRAPPBCL2NOS1NOS2
SCHEMBL6155295 0.82 APP (0.40) APPBCHEKDM4EMEN1ALDH1A1
SCHEMBL6155846 0.82 VDR (0.46) VDRBCHEKMT2ABCL2MAOB
SCHEMBL6155129 0.80 VDR (0.48) VDRAPPBCL2NOS1NOS2
SCHEMBL2107016 0.78 VDR (0.48) VDRBCHENOS1NOS2MAOB
SCHEMBL6156102 0.77 VDR (0.48) VDRAPPNOS1NOS2ALOX5
SCHEMBL6155571 0.76 VDR (0.46) VDRBCHEALOX5
SCHEMBL6155828 0.75 BCHE (0.50) VDRBCHEKDM4ETHRB
SCHEMBL6886823 0.74 VDR (0.45) VDRBCHENOS1NOS2

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