SCHEMBL15635938

SCHEMBL15635938

Cc1ccc(C(CC(=O)O)NC(=O)c2cc(O)n(-c3cc(C)ccc3C)n2)cc1

nearest known ligand 0.53

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ CTSA P10619 19/20 0.53
▸ CYP26A1 O43174 1/20 0.47

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
SCHEMBL15637644 0.94 CTSA (0.50) CTSACYP26A1
SCHEMBL15636323 0.94 CTSA (0.62) CTSA
SCHEMBL15637176 0.93 CTSA (0.49) CTSACYP26A1
SCHEMBL15636746 0.93 CTSA (0.62) CTSA
SCHEMBL15636477 0.92 CTSA (0.53) CTSA
SCHEMBL15635473 0.92 CTSA (0.49) CTSACYP26A1
SCHEMBL15636430 0.92 CTSA (0.50) CTSACYP26A1
SCHEMBL15636447 0.92 CTSA (0.48) CTSACYP26A1
SCHEMBL15635984 0.91 CTSA (0.51) CTSACYP26A1
SCHEMBL15636426 0.90 CYP26A1 (0.55) CTSACYP26A1

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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