SCHEMBL15636717

SCHEMBL15636717

COc1cccc(F)c1C(CC(=O)O)NC(=O)c1cc(O)n(-c2ccc(Cl)cc2)n1

nearest known ligand 0.51

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ APLNR P35414 4/20 0.51
▸ CTSA P10619 16/20 0.50
▸ MME P08473 1/20 0.48
▸ CYP3A4 P08684 1/20 0.48

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
SCHEMBL15636557 0.93 CTSA (0.53) APLNRCTSAMMECYP3A4
SCHEMBL15637393 0.91 CTSA (0.49) CTSAMMECYP3A4
SCHEMBL15636186 0.88 CTSA (0.53) CTSAMMECYP3A4
SCHEMBL15637162 0.86 CTSA (0.55) CTSA
SCHEMBL15636994 0.86 CTSA (0.52) APLNRCTSAMMECYP3A4
SCHEMBL15636120 0.85 APLNR (0.49) APLNRCTSAMMECYP3A4
SCHEMBL15637631 0.85 CTSA (0.50) APLNRCTSA
SCHEMBL15635949 0.83 CTSA (0.50) CTSAMMECYP3A4
SCHEMBL15636444 0.83 CTSA (0.50) CTSAMMECYP3A4
SCHEMBL15636604 0.83 CTSA (0.52) CTSAMMECYP3A4

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2826772-A1 Intermediates for the synthesis of oxygen-substituted 3-heteroaroylamino-propionic acid derivatives SANOFI (FR) 2015-01-21 — — EP disclosed
EP-2528902-B1 OXYGEN-SUBSTITUTED 3-HETEROAROYLAMINO-PROPIONIC ACID DERIVATIVES AND THEIR USE AS PHARMACEUTICALS SANOFI SA (FR) 2014-11-12 — — EP disclosed
WO-2014053533-A1 USE OF SUBSTITUTED 3-HETEROAROYLAMINO-PROPIONIC ACID DERIVATIVES AS PHARMACEUTICALS FOR PREVENTION/TREATMENT OF ATRIAL FIBRILLATION SANOFI (FR) 2014-04-10 — — WO disclosed
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