SCHEMBL6564726

SCHEMBL6564726

Cc1cc(Br)ccc1-c1cccc(OCc2ccc(C(O)c3ccc(COc4cccc(-c5ccc(Br)cc5C)c4)cc3CO)c(CO)c2)c1

nearest known ligand 0.42

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
MAOB P27338 11/20 0.42
MAOA P21397 1/20 0.41
FFAR1 O14842 6/20 0.40
FFAR4 Q5NUL3 1/20 0.37
VDR P11473 1/20 0.36
MRGPRX4 Q96LA9 1/20 0.36

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
SCHEMBL6566495 0.88 MAOB (0.46) MAOBMAOAFFAR1FFAR4VDR
SCHEMBL7608820 0.77 VDR (0.43) MAOBFFAR1FFAR4VDR
SCHEMBL6564051 0.77 MAOB (0.39) MAOBMAOAFFAR1FFAR4
SCHEMBL6566235 0.76 VDR (0.43) FFAR1FFAR4VDR
SCHEMBL6565068 0.76 FFAR1 (0.49) MAOBMAOAFFAR1FFAR4MRGPRX4
SCHEMBL7612585 0.76 VDR (0.44) FFAR1FFAR4VDR
SCHEMBL6565081 0.75 VDR (0.43) FFAR1FFAR4VDR
SCHEMBL7115523 0.74 FFAR1 (0.45) MAOBMAOAFFAR1FFAR4MRGPRX4
SCHEMBL6564056 0.74 MAOB (0.40) MAOBMAOAFFAR1FFAR4
SCHEMBL7610505 0.74 VDR (0.43) FFAR1FFAR4VDR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6831106-B1 Selective activity on cell proliferation and differentiation without displaying any hypercalcaemiant nature GALDERMA RESEARCH & DEVELOPMENT, S.N.C. (FR) 2004-12-14 US disclosed
EP-1235777-B1 VITAMIN D ANALOGUES GALDERMA RES & DEV (FR) 2004-06-16 EP disclosed