SCHEMBL6155252

SCHEMBL6155252

CC(=O)c1cccc(COc2ccc(CO[Si](C)(C)C(C)(C)C)c(CO[Si](C)(C)C(C)(C)C)c2)c1

nearest known ligand 0.52

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MAOB P27338 17/20 0.52
MAOA P21397 4/20 0.51
MRGPRX4 Q96LA9 3/20 0.44
TP53 P04637 2/20 0.44
PKM P14618 2/20 0.44
NFKB1 P19838 2/20 0.44
NFKB2 Q00653 2/20 0.44
RELA Q04206 2/20 0.44
SMN1; SMN2 Q16637 2/20 0.44
RAB9A P51151 1/20 0.44
RXFP1 Q9HBX9 1/20 0.44

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
SCHEMBL6156231 0.86 MAOB (0.41) MAOBMAOAMRGPRX4
SCHEMBL6155642 0.84 MRGPRX4 (0.40) MAOBMRGPRX4TP53PKMNFKB1
SCHEMBL6155645 0.84 MRGPRX4 (0.40) MAOBMRGPRX4TP53PKMNFKB1
SCHEMBL6156248 0.82 VDR (0.40) MAOBMRGPRX4TP53PKMNFKB1
SCHEMBL6885661 0.82 VDR (0.40) MAOBMRGPRX4TP53PKMNFKB1
SCHEMBL6885664 0.82 VDR (0.40) MAOBMRGPRX4TP53PKMNFKB1
SCHEMBL7770639 0.82 MAOB (0.38) MAOBMAOARAB9A
SCHEMBL6878953 0.81 MRGPRX4 (0.39) MAOBMRGPRX4TP53PKMNFKB1
SCHEMBL6881388 0.80 VDR (0.49) MAOBMRGPRX4TP53PKMNFKB1
SCHEMBL6881384 0.80 VDR (0.49) MAOBMRGPRX4TP53PKMNFKB1

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 4 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 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