SCHEMBL6563998

SCHEMBL6563998

Cc1cc(C(=O)O)cc(C)c1-c1cccc(OCc2ccc(COC(=O)c3ccccc3)c(COC(=O)c3ccccc3)c2)c1

nearest known ligand 0.53

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MRGPRX4 Q96LA9 7/20 0.53
NR4A2 P43354 5/20 0.50
FFAR1 O14842 6/20 0.47
FFAR4 Q5NUL3 1/20 0.46
MAOB P27338 1/20 0.45
PTGER4 P35408 1/20 0.43
NR4A1 P22736 1/20 0.43
NR4A3 Q92570 1/20 0.43

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
SCHEMBL6890556 0.92 NR1H2 (0.47) MRGPRX4NR4A2FFAR1FFAR4MAOB
SCHEMBL6564818 0.88 MRGPRX4 (0.54) MRGPRX4NR4A2FFAR1FFAR4NR4A1
SCHEMBL6566359 0.87 MRGPRX4 (0.66) MRGPRX4NR4A2MAOBNR4A1NR4A3
SCHEMBL6562842 0.86 MRGPRX4 (0.47) MRGPRX4NR4A2FFAR1MAOB
SCHEMBL6566172 0.85 MRGPRX4 (0.63) MRGPRX4NR4A2PTGER4
SCHEMBL6562981 0.85 MRGPRX4 (0.52) MRGPRX4NR4A2MAOBPTGER4
SCHEMBL6887724 0.85 MRGPRX4 (0.53) MRGPRX4NR4A2MAOBPTGER4
SCHEMBL6883961 0.84 MRGPRX4 (0.55) MRGPRX4NR4A2MAOBPTGER4
SCHEMBL6888101 0.83 MRGPRX4 (0.47) MRGPRX4NR4A2FFAR1FFAR4MAOB
SCHEMBL6882555 0.82 MRGPRX4 (0.55) MRGPRX4NR4A2FFAR1MAOBPTGER4

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1235777-B1 VITAMIN D ANALOGUES GALDERMA RES & DEV (FR) 2004-06-16 EP disclosed
EP-1235777-A2 VITAMIN D ANALOGUES Galderma Research & Development, S.N.C. (FR) 2002-09-04 EP disclosed
WO-2001038303-A2 VITAMIN D ANALOGUES GALDERMA RESEARCH & DEVELOPMENT, S.N.C. (FR) 2001-05-31 WO disclosed