SCHEMBL17896445

SCHEMBL17896445

COc1ccc(F)c(-c2ccc(OCc3cccc(C(CC(=O)O)C4CC4)c3)cc2C(O)C(C)(C)C)c1

nearest known ligand 0.77

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 20/20 0.77

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
SCHEMBL4274646 0.95 FFAR1 (0.86) FFAR1
SCHEMBL3715781 0.95 FFAR1 (0.86) FFAR1
SCHEMBL13882285 0.95 FFAR1 (0.86) FFAR1
SCHEMBL15213179 0.94 FFAR1 (0.72) FFAR1
SCHEMBL16318771 0.92 FFAR1 (0.77) FFAR1
SCHEMBL16318847 0.91 FFAR1 (0.73) FFAR1
SCHEMBL16318530 0.89 FFAR1 (0.81) FFAR1
SCHEMBL16318723 0.89 FFAR1 (0.75) FFAR1
SCHEMBL16318929 0.89 FFAR1 (0.80) FFAR1
SCHEMBL16318600 0.89 FFAR1 (0.76) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9382188-B2 Aromatic ring compound TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2016-07-05 US disclosed
US-9382188-B2 Aromatic ring compound TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2016-07-05 US disclosed