SCHEMBL27759282

SCHEMBL27759282

NC(=O)c1ccccc1-c1cc(-c2ccnc(N)n2)[nH]c1-c1cccnc1

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CDC7 O00311 13/20 0.65
JAK2 O60674 9/20 0.65
CDK1 P06493 3/20 0.65
CDK2 P24941 3/20 0.65
GSK3B P49841 3/20 0.65
TAOK1 Q7L7X3 3/20 0.65
CDK9 P50750 2/20 0.65
IKBKB O14920 1/20 0.65
CCNT1 O60563 1/20 0.65
CCNB2 O95067 1/20 0.65
CCNE2 O96020 1/20 0.65
PRKCB P05771 1/20 0.65
CCNB1 P14635 1/20 0.65
CCNA2 P20248 1/20 0.65
CCNE1 P24864 1/20 0.65
CCNA1 P78396 1/20 0.65
CCNB3 Q8WWL7 1/20 0.65
PLK4 O00444 2/20 0.56
MAPK13 O15264 2/20 0.56
DAPK3 O43293 2/20 0.56

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
SCHEMBL27738496 0.91 CDC7 (0.79) CDC7JAK2CDK1CDK2GSK3B
Hydrochloric Acid SCHEMBL27851387 0.89 CDC7 (0.77) CDC7JAK2CDK1CDK2GSK3B
SCHEMBL4178840 0.88 CDC7 (0.79) CDC7JAK2CDK1CDK2GSK3B
SCHEMBL27738508 0.85 JAK2 (0.79) CDC7JAK2CDK1CDK2GSK3B
SCHEMBL28779570 0.84 JAK2 (0.67) CDC7JAK2CDK1CDK2GSK3B
SCHEMBL27738498 0.83 CDC7 (0.77) CDC7JAK2CDK1CDK2GSK3B
SCHEMBL28779558 0.82 JAK2 (0.84) CDC7JAK2CDK1CDK2GSK3B
SCHEMBL28779559 0.82 JAK2 (0.64) CDC7JAK2CDK1CDK2GSK3B
SCHEMBL27759277 0.82 JAK2 (0.64) CDC7JAK2CDK1CDK2GSK3B
SCHEMBL27851407 0.82 JAK2 (0.84) CDC7JAK2CDK1CDK2GSK3B

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
CN-101410387-B Pyridyl-and pyrimidinyl-substituted pyrrole-, thiophene-and furan-derivatives as kinase inhibitors NERVIANO MEDICAL SCIENCES SRL 2013-12-18 CN disclosed
CN-101410387-A Pyridyl-and pyrimidinyl-substituted pyrrole-, thiophene-and furan-derivatives as kinase inhibitors NERVIANO MEDICAL SCIENCES SRL (IT) 2009-04-15 CN disclosed