SCHEMBL15636670

SCHEMBL15636670

N#Cc1ccc([C@H](CC(=O)O)NC(=O)c2cc(O)n(-c3ccc(Cl)cc3)n2)cc1

nearest known ligand 0.49

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ EGLN2 Q96KS0 2/20 0.49
▸ EGLN1 Q9GZT9 2/20 0.49
▸ CTSA P10619 5/20 0.47
▸ CYP26A1 O43174 5/20 0.44
▸ CYP2D6 P10635 1/20 0.44
▸ CYP2C9 P11712 1/20 0.44
▸ SLC6A9 P48067 1/20 0.44
▸ SLC6A5 Q9Y345 1/20 0.44
▸ ABCB1 P08183 1/20 0.43
▸ EEF2K O00418 2/20 0.41
▸ RXRA P19793 1/20 0.41
▸ RXRB P28702 1/20 0.41
▸ RXRG P48443 1/20 0.41

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
SCHEMBL15636384 0.93 CTSA (0.53) EGLN2EGLN1CTSACYP26A1
SCHEMBL15636578 0.92 EGLN2 (0.52) EGLN2EGLN1CTSACYP26A1EEF2K
SCHEMBL15637304 0.91 EGLN2 (0.46) EGLN2EGLN1CTSACYP26A1EEF2K
SCHEMBL15636129 0.90 EGLN2 (0.46) EGLN2EGLN1CTSACYP26A1
SCHEMBL15636873 0.90 CTSA (0.47) EGLN2EGLN1CTSAEEF2K
SCHEMBL15635631 0.90 CTSA (0.54) EGLN2EGLN1CTSACYP26A1
SCHEMBL15636227 0.90 CTSA (0.54) EGLN2EGLN1CTSACYP26A1
SCHEMBL15635884 0.88 CTSA (0.52) CTSACYP26A1
SCHEMBL15636772 0.88 CTSA (0.52) CTSACYP26A1
SCHEMBL15636942 0.88 CTSA (0.52) 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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