SCHEMBL7326748

SCHEMBL7326748

CC1(C)C=C(n2cccc(Cl)c2=O)c2ccncc2O1

nearest known ligand 0.35

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CCNC P24863 18/20 0.35
CDK8 P49336 18/20 0.35
HASPIN Q8TF76 17/20 0.35
CDK19 Q9BWU1 11/20 0.35
FGFR1 P11362 2/20 0.30
SRC P12931 2/20 0.30
EGFR P00533 1/20 0.30

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
SCHEMBL7314077 0.91 FGFR1 (0.32) CCNCCDK8HASPINCDK19FGFR1
SCHEMBL7297858 0.86 CCNC (0.37) CCNCCDK8HASPINCDK19
SCHEMBL7288548 0.86 CCNC (0.38) CCNCCDK8HASPINCDK19
SCHEMBL7299106 0.84 CCNC (0.39) CCNCCDK8HASPINCDK19
SCHEMBL7377775 0.83 CCNC (0.43) CCNCCDK8HASPINCDK19
SCHEMBL7291289 0.83 CCNC (0.34) CCNCCDK8HASPINCDK19
SCHEMBL7294332 0.83 CCNC (0.37) CCNCCDK8HASPINCDK19
SCHEMBL7298021 0.82 CA12 (0.40) CCNCCDK8HASPINCDK19
SCHEMBL7375175 0.81 CCNC (0.37) CCNCCDK8HASPINCDK19
SCHEMBL7291526 0.81 CCNC (0.40) 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 3 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
EP-0308792-A2 Azachromane derivatives MERCK PATENT GmbH (DE) 1989-03-29 EP disclosed