SCHEMBL19035444

SCHEMBL19035444

COC(=O)CC(c1cccc(OCc2cnc(-c3cc(OC)ccc3F)c(-c3cc(C)cc(C)c3)n2)c1)C1CC1

nearest known ligand 0.88

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 20/20 0.88

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
SCHEMBL17428346 1.00 FFAR1 (0.88) FFAR1
SCHEMBL17418605 0.93 FFAR1 (1.00) FFAR1
SCHEMBL17418760 0.93 FFAR1 (1.00) FFAR1
SCHEMBL17418755 0.91 FFAR1 (0.88) FFAR1
SCHEMBL17418757 0.91 FFAR1 (0.88) FFAR1
SCHEMBL17418727 0.89 FFAR1 (0.72) FFAR1
SCHEMBL17418725 0.89 FFAR1 (0.72) FFAR1
SCHEMBL17419029 0.88 FFAR1 (1.00) FFAR1
SCHEMBL17419050 0.88 FFAR1 (1.00) FFAR1
SCHEMBL17419081 0.87 FFAR1 (0.87) 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
US-9688642-B2 Substituted pyrazines as GPR40 agonists JANSSEN PHARMACEUTICA NV (BE) 2017-06-27 US disclosed