SCHEMBL6155295

SCHEMBL6155295

CCN(CCCC(C)(C)O)c1cccc(OCc2ccc(C(O)O)cc2)c1

nearest known ligand 0.41

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
APP P05067 2/20 0.40
BCHE P06276 4/20 0.39
CETP P11597 4/20 0.39
KDM4E B2RXH2 1/20 0.38
MEN1 O00255 1/20 0.38
ALDH1A1 P00352 1/20 0.38
THRB P10828 1/20 0.38
KMT2A Q03164 1/20 0.38
BCL2 P10415 1/20 0.38
NR4A1 P22736 1/20 0.35
NR4A2 P43354 1/20 0.35
NR4A3 Q92570 1/20 0.35

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
SCHEMBL6155835 0.87 APP (0.44) APPBCL2NR4A1NR4A2NR4A3
SCHEMBL6155493 0.84 APP (0.44) APPBCL2NR4A1NR4A2NR4A3
SCHEMBL6155289 0.82 VDR (0.46) APPBCHECETPKDM4EMEN1
SCHEMBL6155868 0.82 CETP (0.46) BCHECETPKMT2ABCL2
SCHEMBL6155134 0.79 APP (0.43) APPBCHEBCL2
SCHEMBL2107020 0.78 CYP4F2 (0.46) APPBCHEMEN1KMT2ANR4A1
SCHEMBL6155587 0.77 CYSLTR2 (0.44) APPBCHEMEN1KMT2ANR4A1
SCHEMBL6156106 0.76 APP (0.42) APPBCHEBCL2
SCHEMBL6886826 0.76 RRM1 (0.47) APPBCHEMEN1KMT2A
SCHEMBL6156502 0.76 BCL2 (0.44) APPBCL2NR4A1NR4A2NR4A3

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
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