SCHEMBL19035470

SCHEMBL19035470

CCOC(=O)CC(c1cccc(OCc2cnc(-c3cc(OC)ncc3F)c(Cl)n2)c1)C1CC1

nearest known ligand 0.68

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 20/20 0.68
CYP3A4 P08684 1/20 0.68
CYP2C8 P10632 1/20 0.68

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
SCHEMBL17431590 1.00 FFAR1 (0.68) FFAR1CYP3A4CYP2C8
SCHEMBL17419160 0.93 FFAR1 (0.70) FFAR1CYP3A4CYP2C8
SCHEMBL17419161 0.93 FFAR1 (0.70) FFAR1CYP3A4CYP2C8
SCHEMBL17428387 0.92 FFAR1 (0.57) FFAR1CYP3A4CYP2C8
SCHEMBL17418570 0.91 FFAR1 (0.81) FFAR1CYP3A4CYP2C8
SCHEMBL17431696 0.90 FFAR1 (0.69) FFAR1
SCHEMBL19035463 0.90 FFAR1 (0.69) FFAR1
SCHEMBL17428331 0.90 FFAR1 (0.61) FFAR1
SCHEMBL17431751 0.89 FFAR1 (0.84) FFAR1CYP3A4CYP2C8
SCHEMBL19035491 0.89 FFAR1 (0.84) FFAR1CYP3A4CYP2C8

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