SCHEMBL17998364

SCHEMBL17998364

COc1ncc(C(=O)N[C@@H](CC(=O)O)c2ccccc2Cl)cc1-c1cc(F)cc(F)c1

nearest known ligand 0.88

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ CTSA P10619 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
SCHEMBL17998367 1.00 CTSA (0.88) CTSA
SCHEMBL17998451 0.94 CTSA (1.00) CTSA
SCHEMBL17998449 0.94 CTSA (1.00) CTSA
SCHEMBL17998277 0.93 CTSA (1.00) CTSA
SCHEMBL17998276 0.93 CTSA (1.00) CTSA
SCHEMBL12498983 0.92 CTSA (1.00) CTSA
SCHEMBL12498990 0.92 CTSA (1.00) CTSA
SCHEMBL17998290 0.90 CTSA (0.84) CTSA
SCHEMBL17998293 0.90 CTSA (0.84) CTSA
SCHEMBL17998633 0.90 CTSA (0.87) CTSA

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
EP-2667870-B1 SUBSTITUTED 3-HETEROAROYLAMINO-PROPIONIC ACID DERIVATIVES AND THEIR USE AS PHARMACEUTICALS SANOFI SA (FR) 2016-08-24 — — EP disclosed
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