SCHEMBL6155482

SCHEMBL6155482

CC(C)(O)CCCCNCc1cccc(OCc2ccc(CO)c(CO)c2)c1

nearest known ligand 0.49

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
BCHE P06276 9/20 0.49
KDM4E B2RXH2 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
VDR P11473 2/20 0.45
CHRM2 P08172 1/20 0.44
TP53 P04637 1/20 0.42
THRB P10828 1/20 0.42

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
SCHEMBL6155828 0.97 BCHE (0.50) BCHEKDM4ESMN1; SMN2VDRCHRM2
SCHEMBL6156099 0.90 VDR (0.48) BCHEKDM4ESMN1; SMN2VDRCHRM2
SCHEMBL6886823 0.88 VDR (0.45) BCHEVDR
SCHEMBL6155122 0.87 VDR (0.48) BCHEKDM4ESMN1; SMN2VDRCHRM2
SCHEMBL6156190 0.86 BCHE (0.48) BCHEKDM4ESMN1; SMN2CHRM2
SCHEMBL2107016 0.86 VDR (0.48) BCHESMN1; SMN2VDR
SCHEMBL6156495 0.83 BCHE (0.49) BCHEKDM4ESMN1; SMN2
SCHEMBL6885228 0.82 BCHE (0.53) BCHEKDM4ESMN1; SMN2CHRM2TP53
SCHEMBL7048973 0.79 BCHE (0.52) BCHEKDM4ESMN1; SMN2
SCHEMBL6886751 0.79 BCHE (0.54) BCHEKDM4ESMN1; SMN2CHRM2TP53

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