SCHEMBL17998278

SCHEMBL17998278

COc1cccc(-c2cc(C(=O)N[C@@H](CC(=O)O)c3ccccc3Cl)cnc2OC)c1

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
SCHEMBL17998281 1.00 CTSA (1.00) CTSA
SCHEMBL17998519 0.93 CTSA (0.89) CTSA
SCHEMBL17998518 0.93 CTSA (0.89) CTSA
SCHEMBL12498990 0.93 CTSA (1.00) CTSA
SCHEMBL12498983 0.93 CTSA (1.00) CTSA
SCHEMBL17998380 0.92 CTSA (1.00) CTSA
SCHEMBL17998382 0.92 CTSA (1.00) CTSA
SCHEMBL17998459 0.91 CTSA (1.00) CTSA
SCHEMBL17998451 0.91 CTSA (1.00) CTSA
SCHEMBL17998449 0.91 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
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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