SCHEMBL15636249

SCHEMBL15636249

Cc1ccc([C@H](CC(=O)O)NC(=O)c2cc(O)n(-c3ccccc3)n2)cc1

nearest known ligand 0.53

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ CYP26A1 O43174 4/20 0.53
▸ CTSA P10619 16/20 0.53

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
SCHEMBL15636745 1.00 CYP26A1 (0.53) CYP26A1CTSA
SCHEMBL16223863 0.92 CTSA (0.54) CTSA
SCHEMBL15636386 0.92 CTSA (0.54) CTSA
SCHEMBL15637059 0.91 CYP26A1 (0.53) CYP26A1CTSA
SCHEMBL16223720 0.91 CTSA (0.57) CYP26A1CTSA
SCHEMBL15637270 0.91 CTSA (0.57) CYP26A1CTSA
SCHEMBL15636168 0.90 CTSA (0.57) CYP26A1CTSA
SCHEMBL15636448 0.90 CTSA (0.56) CTSA
SCHEMBL15636404 0.89 CTSA (0.56) CYP26A1CTSA
SCHEMBL15636922 0.89 CTSA (0.56) CYP26A1CTSA

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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