SCHEMBL17998389

SCHEMBL17998389

COc1ncc(C(=O)NC(CC(=O)O)c2ccccc2C)cc1-c1ccc(C#N)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
SCHEMBL17998386 1.00 CTSA (1.00) CTSA
SCHEMBL17998475 0.92 CTSA (0.84) CTSA
SCHEMBL17998473 0.92 CTSA (0.84) CTSA
SCHEMBL17998305 0.91 CTSA (1.00) CTSA
SCHEMBL17998303 0.91 CTSA (1.00) CTSA
SCHEMBL17998485 0.91 CTSA (0.83) CTSA
SCHEMBL17998483 0.91 CTSA (0.83) CTSA
SCHEMBL17998488 0.90 CTSA (1.00) CTSA
SCHEMBL17998486 0.90 CTSA (1.00) CTSA
SCHEMBL17998621 0.89 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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