SCHEMBL6566452

SCHEMBL6566452

CC=C(O)c1ccc(-c2cccc(COc3ccc(CO)c(CO)c3)c2)c(C)c1

nearest known ligand 0.48

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 17/20 0.48
FFAR4 Q5NUL3 2/20 0.44
NR1H4 Q96RI1 1/20 0.43
PPARD Q03181 1/20 0.41
VDR P11473 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
SCHEMBL6566449 1.00 FFAR1 (0.48) FFAR1FFAR4NR1H4PPARDVDR
SCHEMBL6566456 0.82 FFAR1 (0.51) FFAR1FFAR4NR1H4
SCHEMBL7606646 0.80 FFAR1 (0.51) FFAR1FFAR4VDR
SCHEMBL6563025 0.79 VDR (0.58) FFAR1FFAR4NR1H4PPARDVDR
SCHEMBL6566288 0.78 FFAR1 (0.45) FFAR1FFAR4
SCHEMBL6566495 0.76 MAOB (0.46) FFAR1FFAR4VDR
SCHEMBL7608281 0.76 FFAR1 (0.43) FFAR1FFAR4
SCHEMBL7606371 0.76 FFAR1 (0.47) FFAR1FFAR4PPARDVDR
SCHEMBL7606369 0.76 FFAR1 (0.43) FFAR1FFAR4VDR
SCHEMBL2022470 0.74 FFAR1 (0.53) FFAR1FFAR4PPARD

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 1 patent. 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