SCHEMBL14567232

SCHEMBL14567232

CC#CC(CC(=O)OC)c1ccc(OC2CCc3ccc(OC)cc32)cc1

nearest known ligand 0.67

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 17/20 0.67
MTNR1A P48039 3/20 0.44
NQO2 P16083 2/20 0.43
MTNR1B P49286 2/20 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
SCHEMBL13616706 1.00 FFAR1 (0.67) FFAR1MTNR1ANQO2MTNR1B
SCHEMBL13616712 0.93 FFAR1 (0.66) FFAR1
SCHEMBL14567257 0.93 FFAR1 (0.66) FFAR1
SCHEMBL14567231 0.92 FFAR1 (0.79) FFAR1
SCHEMBL3858987 0.92 FFAR1 (0.79) FFAR1
SCHEMBL13616827 0.92 FFAR1 (0.79) FFAR1
SCHEMBL13616698 0.90 FFAR1 (0.62) FFAR1
SCHEMBL14567159 0.90 FFAR1 (0.62) FFAR1
SCHEMBL13616732 0.89 FFAR1 (0.81) FFAR1
SCHEMBL13616749 0.87 FFAR1 (0.65) FFAR1

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
WO-2007033002-A1 CONFORMATIONALLY CONSTRAINED 3- (4-HYDROXY-PHENYL) - SUBSTITUTED-PROPANOIC ACIDS USEFUL FOR TREATING METABOLIC DISORDERS AMGEN INC. (US) 2007-03-22 WO disclosed