SCHEMBL7375175

SCHEMBL7375175

CC1(C)C=C(n2cccnc2=O)c2ccncc2O1

nearest known ligand 0.37

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CCNC P24863 19/20 0.37
CDK8 P49336 19/20 0.37
HASPIN Q8TF76 18/20 0.37
CDK19 Q9BWU1 13/20 0.37
AAK1 Q2M2I8 1/20 0.31

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
SCHEMBL7373229 0.90 ABCC9 (0.30) CCNCCDK8HASPINCDK19
SCHEMBL7298021 0.84 CA12 (0.40) CCNCCDK8HASPINCDK19
SCHEMBL7298792 0.81 CCNC (0.39) CCNCCDK8HASPINCDK19
SCHEMBL7326748 0.81 CCNC (0.35) CCNCCDK8HASPINCDK19
SCHEMBL7379472 0.81 CCNC (0.38) CCNCCDK8HASPINCDK19
SCHEMBL7288548 0.81 CCNC (0.38) CCNCCDK8HASPINCDK19
SCHEMBL7297858 0.81 CCNC (0.37) CCNCCDK8HASPINCDK19
SCHEMBL7299106 0.79 CCNC (0.39) CCNCCDK8HASPINCDK19
SCHEMBL7376892 0.79
SCHEMBL7372344 0.79 CCNC (0.39) CCNCCDK8HASPINCDK19

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0308792-B1 AZACHROMANE DERIVATIVES MERCK PATENT GmbH (DE) 1993-07-28 EP disclosed
US-4931454-A Azachroman derivatives with effects on the cardiovascular system MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1990-06-05 US disclosed