SCHEMBL15636940

SCHEMBL15636940

O=C(O)C[C@H](NC(=O)c1cc(O)n(-c2ccc(F)cc2)n1)c1cccc(Cl)c1Cl

nearest known ligand 0.55

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ CTSA P10619 19/20 0.55
▸ APLNR P35414 1/20 0.46

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
SCHEMBL15636104 1.00 CTSA (0.55) CTSAAPLNR
SCHEMBL15636599 0.92 CTSA (0.52) CTSAAPLNR
SCHEMBL15636032 0.92 CTSA (0.55) CTSA
SCHEMBL15636975 0.92 CTSA (0.55) CTSA
SCHEMBL15637045 0.92 CTSA (0.59) CTSA
SCHEMBL16223766 0.92 CTSA (0.59) CTSA
SCHEMBL15636757 0.92 CTSA (0.60) CTSA
SCHEMBL15636861 0.92 CTSA (0.60) CTSA
SCHEMBL15636820 0.91 CTSA (0.54) CTSA
SCHEMBL15636172 0.91 CTSA (0.54) 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
Send feedback