SCHEMBL15636577

SCHEMBL15636577

O=C(O)C[C@H](NC(=O)c1cc(O)n(-c2ccc(F)cc2)n1)c1ccc(Cl)cc1Cl

nearest known ligand 0.58

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ CTSA P10619 18/20 0.58
▸ EEF2K O00418 1/20 0.47
▸ APLNR P35414 1/20 0.44

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
SCHEMBL15637436 0.94 CTSA (0.57) CTSA
SCHEMBL15637117 0.92 MME (0.52) CTSAAPLNR
SCHEMBL15637036 0.92 CTSA (0.52) CTSAAPLNR
SCHEMBL15635939 0.92 CTSA (0.59) CTSA
SCHEMBL15637384 0.91 CTSA (0.57) CTSAEEF2K
SCHEMBL15637045 0.90 CTSA (0.59) CTSA
SCHEMBL16223766 0.90 CTSA (0.59) CTSA
SCHEMBL15635849 0.89 MME (0.51) CTSA
SCHEMBL15636006 0.89 CTSA (0.58) CTSA
SCHEMBL2317278 0.89 CTSA (0.49) CTSAAPLNR

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
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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