SCHEMBL15635936

SCHEMBL15635936

CCc1ccc(C(CC(=O)O)NC(=O)c2cc(O)n(-c3cccc(Cl)c3)n2)cc1

nearest known ligand 0.47

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ CTSA P10619 16/20 0.47
▸ CYP26A1 O43174 3/20 0.46
▸ DCAF1 Q9Y4B6 1/20 0.42

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
SCHEMBL15636621 0.91 CYP26A1 (0.49) CTSACYP26A1
SCHEMBL16223720 0.90 CTSA (0.57) CTSACYP26A1
SCHEMBL15637270 0.90 CTSA (0.57) CTSACYP26A1
SCHEMBL15636487 0.90 CTSA (0.46) CTSACYP26A1
SCHEMBL15636445 0.88 CTSA (0.60) CTSACYP26A1DCAF1
SCHEMBL15635967 0.88 CTSA (0.53) CTSACYP26A1
SCHEMBL15635977 0.88 CTSA (0.57) CTSACYP26A1DCAF1
SCHEMBL15636694 0.88 CTSA (0.57) CTSACYP26A1DCAF1
SCHEMBL15636099 0.88 CTSA (0.55) CTSACYP26A1
SCHEMBL15637304 0.86 EGLN2 (0.46) CTSACYP26A1DCAF1

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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