SCHEMBL9457344

SCHEMBL9457344

CCCCCCCC/C=C\CCCCCCC[C@@H](C[C@H](O)CC(=O)O)OC1CCCCO1

nearest known ligand 0.47

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 1/20 0.41
FFAR4 Q5NUL3 1/20 0.41
GPR84 Q9NQS5 4/20 0.40
FAAH O00519 1/20 0.37
PPARG P37231 2/20 0.35
DGKA P23743 1/20 0.35
GPR132 Q9UNW8 1/20 0.35

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
SCHEMBL9457408 1.00 FFAR1 (0.41) FFAR1FFAR4GPR84FAAHPPARG
SCHEMBL9457411 1.00 FFAR1 (0.41) FFAR1FFAR4GPR84FAAHPPARG
SCHEMBL9457356 1.00 FFAR1 (0.41) FFAR1FFAR4GPR84FAAHPPARG
SCHEMBL9457278 0.97 NFKB1 (0.40) FFAR1FFAR4PPARG
SCHEMBL9457270 0.97 NFKB1 (0.40) FFAR1FFAR4PPARG
Hexane SCHEMBL9734238 0.94 GPR84 (0.46) FFAR1FFAR4GPR84
SCHEMBL9457366 0.91 FFAR1 (0.39) FFAR1FFAR4FAAHPPARG
SCHEMBL9457402 0.91 FFAR1 (0.39) FFAR1FFAR4FAAHPPARG
SCHEMBL9457394 0.91 FFAR1 (0.39) FFAR1FFAR4FAAHPPARG
SCHEMBL9457388 0.91 FFAR1 (0.39) FFAR1FFAR4FAAHPPARG

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
US-5246960-A Used to treat obesity, hyperlipaemia, atherosclerosis and arteriosclerosis HOFFMANN-LA ROCHE INC. (US) 1993-09-21 US disclosed
US-5175186-A Inhibits pancreas lepase and useful agent in treatment of obesity, hyperlipemia, atherosclerosis and arteriosclerosis HOFFMANN-LA ROCHE INC. (US) 1992-12-29 US disclosed
US-4931463-A PANCREAS LIPASE INHIBITORS HOFFMANN-LA ROCHE INC. (US) 1990-06-05 US disclosed