SCHEMBL17573082

SCHEMBL17573082

C=Cc1cncc(Br)c1C=O

nearest known ligand 0.32

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ CCNC P24863 1/20 0.32
▸ CDK8 P49336 1/20 0.32

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
SCHEMBL567898 0.80 CCNC (0.34) CCNCCDK8
SCHEMBL19656322 0.76 — —
SCHEMBL1563913 0.75 ALDH1A1 (0.38) CCNCCDK8
SCHEMBL21392315 0.72 EGFR (0.32) —
SCHEMBL26122121 0.72 EGFR (0.32) —
SCHEMBL30556857 0.72 EGFR (0.32) —
SCHEMBL29923236 0.71 CCNC (0.33) CCNCCDK8
SCHEMBL30959346 0.71 ERN1 (0.38) CCNCCDK8
SCHEMBL30702047 0.71 CA1 (0.31) CCNCCDK8
SCHEMBL6118301 0.71 ERN1 (0.38) CCNCCDK8

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
EP-2993169-A1 ARYL-PYRIDINE DERIVATIVES AS ALDOSTERONE SYNTHASE INHIBITORS Novartis AG (CH) 2016-03-09 — — EP disclosed
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