SCHEMBL10179605

SCHEMBL10179605

COC1(CNc2nc(-c3ccncc3Cl)ccc2F)CCOCC1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CCNT1 O60563 4/20 0.39
PRKCH P24723 2/20 0.36
PRKCE Q02156 2/20 0.36
PRKCQ Q04759 2/20 0.36
PRKCD Q05655 2/20 0.36
CDK9 P50750 3/20 0.36
LATS1 O95835 6/20 0.34
EED O75530 1/20 0.33
SUZ12 Q15022 1/20 0.33
EZH2 Q15910 1/20 0.33
PDCD1LG2 Q9BQ51 1/20 0.32
CD274 Q9NZQ7 1/20 0.32
CCNK O75909 1/20 0.32
CDK14 O94921 1/20 0.32
CDK1 P06493 1/20 0.32
CCNA2 P20248 1/20 0.32
CDK2 P24941 1/20 0.32
CDK5 Q00535 1/20 0.32
CDK16 Q00536 1/20 0.32
CDK17 Q00537 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
SCHEMBL1462894 0.84 CCNT1 (0.45) CCNT1CDK9CCNKCDK14CDK1
SCHEMBL1462988 0.77 CCNT1 (0.48) CCNT1CDK9CCNKCDK14CDK1
SCHEMBL1462844 0.75 AOC2 (0.31)
SCHEMBL1463729 0.73 CDK9 (0.75) CCNT1CDK9
SCHEMBL1949578 0.73 CDK9 (0.59) CCNT1CDK9CCNK
SCHEMBL1225997 0.72 ADORA2B (0.35) CCNT1DYRK1B
SCHEMBL1192405 0.72 CCNT1 (0.48) CCNT1CDK9CCNKCDK14CDK1
SCHEMBL1463745 0.72 CDK9 (0.54) CCNT1CDK9CCNKCDK1CCNA2
SCHEMBL1463738 0.71 CCNT1 (0.47) CCNT1CDK9CCNKCDK14CDK1
SCHEMBL1945842 0.71 CCNT1 (0.47) CCNT1CDK9CCNKCDK14CDK1

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-2473499-A1 BIPYRIDINES USEFUL FOR THE TREATMENT OF PROLIFERATIVE DISEASES Novartis AG (CH) 2012-07-11 EP claimed