SCHEMBL15636757

SCHEMBL15636757

O=C(O)CC(NC(=O)c1cc(O)n(-c2ccccc2)n1)c1cccc(Cl)c1Cl

nearest known ligand 0.60

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ CTSA P10619 19/20 0.60
▸ CYP26A1 O43174 1/20 0.49

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
SCHEMBL15636861 1.00 CTSA (0.60) CTSACYP26A1
SCHEMBL15636032 0.94 CTSA (0.55) CTSA
SCHEMBL15635909 0.94 CTSA (0.56) CTSA
SCHEMBL15636975 0.94 CTSA (0.55) CTSA
SCHEMBL15637675 0.94 CTSA (0.56) CTSA
SCHEMBL15637086 0.93 CTSA (0.60) CTSA
SCHEMBL15636474 0.93 CTSA (0.60) CTSA
SCHEMBL15636104 0.92 CTSA (0.55) CTSA
SCHEMBL15636940 0.92 CTSA (0.55) CTSA
SCHEMBL15637249 0.92 CTSA (0.57) 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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