SCHEMBL19035503

SCHEMBL19035503

COc1ccc(F)c(-c2ncc(COc3cccc(C(CC(=O)O)C4CC4)c3)nc2C2CC2)c1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 20/20 1.00

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
SCHEMBL17418658 1.00 FFAR1 (1.00) FFAR1
SCHEMBL17428347 0.91 FFAR1 (0.84) FFAR1
SCHEMBL17419047 0.91 FFAR1 (0.83) FFAR1
SCHEMBL17418862 0.91 FFAR1 (0.83) FFAR1
SCHEMBL17431580 0.91 FFAR1 (0.83) FFAR1
SCHEMBL17419120 0.90 FFAR1 (0.81) FFAR1
SCHEMBL17419153 0.90 FFAR1 (0.81) FFAR1
SCHEMBL19035467 0.89 FFAR1 (1.00) FFAR1
SCHEMBL17418839 0.89 FFAR1 (1.00) FFAR1
SCHEMBL17419044 0.89 FFAR1 (1.00) 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