SCHEMBL15636732

SCHEMBL15636732

O=C(O)C[C@H](NC(=O)c1cc(O)n(-c2ccc(Cl)cc2)n1)c1ccccc1Cl

nearest known ligand 0.57

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ CTSA P10619 20/20 0.57

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
SCHEMBL16223819 1.00 CTSA (0.57) CTSA
SCHEMBL15636474 0.95 CTSA (0.60) CTSA
SCHEMBL15637086 0.95 CTSA (0.60) CTSA
SCHEMBL16223766 0.92 CTSA (0.59) CTSA
SCHEMBL15636032 0.92 CTSA (0.55) CTSA
SCHEMBL15637045 0.92 CTSA (0.59) CTSA
SCHEMBL15636975 0.92 CTSA (0.55) CTSA
SCHEMBL15637436 0.92 CTSA (0.57) CTSA
SCHEMBL15637467 0.91 CTSA (0.59) CTSA
SCHEMBL16223781 0.91 CTSA (0.59) 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2826772-A1 Intermediates for the synthesis of oxygen-substituted 3-heteroaroylamino-propionic acid derivatives SANOFI (FR) 2015-01-21 — — EP disclosed
EP-2528902-B1 OXYGEN-SUBSTITUTED 3-HETEROAROYLAMINO-PROPIONIC ACID DERIVATIVES AND THEIR USE AS PHARMACEUTICALS SANOFI SA (FR) 2014-11-12 — — EP disclosed
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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