SCHEMBL15635684

SCHEMBL15635684

COc1ccc(-c2cccc(C(=O)N[C@@H](CC(=O)O)c3ccccc3C)n2)cc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ CTSA P10619 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
SCHEMBL15635687 1.00 CTSA (1.00) CTSA
SCHEMBL12498200 0.91 CTSA (1.00) CTSA
SCHEMBL12498193 0.91 CTSA (1.00) CTSA
SCHEMBL15636302 0.90 CTSA (1.00) CTSA
SCHEMBL15636300 0.90 CTSA (1.00) CTSA
SCHEMBL5926359 0.86 CTSA (0.75) CTSA
SCHEMBL12498248 0.85 CTSA (1.00) CTSA
SCHEMBL12498252 0.85 CTSA (1.00) CTSA
SCHEMBL15635946 0.85 CTSA (1.00) CTSA
SCHEMBL15635947 0.85 CTSA (1.00) 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
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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