SCHEMBL6156640

SCHEMBL6156640

CCCC(=CCCC(=O)O)c1cccc(OCc2ccc(CO)c(CO)c2)c1

nearest known ligand 0.55

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
VDR P11473 2/20 0.55
MAOB P27338 9/20 0.45
MAOA P21397 3/20 0.42
FFAR1 O14842 1/20 0.42
PTPN1 P18031 1/20 0.41
NR4A2 P43354 4/20 0.41
KMT2A Q03164 1/20 0.41
NR4A1 P22736 1/20 0.41
NR4A3 Q92570 1/20 0.41
TSHR P16473 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41

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
SCHEMBL6156629 1.00 VDR (0.55) VDRMAOBMAOAFFAR1PTPN1
SCHEMBL6156634 1.00 VDR (0.55) VDRMAOBMAOAFFAR1PTPN1
SCHEMBL6156519 0.85 VDR (0.59) VDRMAOBMAOANR4A2NR4A1
SCHEMBL6156515 0.85 VDR (0.59) VDRMAOBMAOANR4A2NR4A1
SCHEMBL6156529 0.85 VDR (0.59) VDRMAOBMAOANR4A2NR4A1
SCHEMBL6157097 0.84 VDR (0.60) VDRMAOBMAOANR4A2NR4A1
SCHEMBL6157106 0.84 VDR (0.60) VDRMAOBMAOANR4A2NR4A1
SCHEMBL6157093 0.84 VDR (0.60) VDRMAOBMAOANR4A2NR4A1
SCHEMBL6156636 0.83 MAOB (0.46) MAOBMAOAFFAR1PTPN1NR4A2
SCHEMBL6154770 0.82 VDR (0.59) VDRMAOBMAOANR4A2NR4A1

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