SCHEMBL27759232

SCHEMBL27759232

Cc1cccc(-c2[nH]c(-c3ccnc(N)n3)cc2-c2ccccc2C(N)=O)c1Br

nearest known ligand 0.70

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
JAK2 O60674 11/20 0.70
CDC7 O00311 12/20 0.67
CDK1 P06493 3/20 0.67
CDK2 P24941 3/20 0.67
GSK3B P49841 3/20 0.67
TAOK1 Q7L7X3 3/20 0.67
PLK4 O00444 2/20 0.67
MAPK13 O15264 2/20 0.67
DAPK3 O43293 2/20 0.67
DYRK3 O43781 2/20 0.67
ROCK2 O75116 2/20 0.67
PRKD3 O94806 2/20 0.67
MAP4K4 O95819 2/20 0.67
PRKCG P05129 2/20 0.67
PIM1 P11309 2/20 0.67
PRKACA P17612 2/20 0.67
MARK3 P27448 2/20 0.67
MAPK1 P28482 2/20 0.67
FRK P42685 2/20 0.67
MAPK8 P45983 2/20 0.67

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
SCHEMBL4177344 0.91 JAK2 (0.81) JAK2CDC7CDK1CDK2GSK3B
SCHEMBL27851407 0.91 JAK2 (0.84) JAK2CDC7CDK1CDK2GSK3B
SCHEMBL27738547 0.90 CDC7 (0.83) JAK2CDC7CDK1CDK2GSK3B
Hydrochloric Acid SCHEMBL27938063 0.90 JAK2 (0.82) JAK2CDC7CDK1CDK2GSK3B
Hydrochloric Acid SCHEMBL27851389 0.89 CDC7 (0.81) JAK2CDC7CDK1CDK2GSK3B
SCHEMBL27759227 0.88 CDC7 (0.67) JAK2CDC7CDK1CDK2GSK3B
SCHEMBL28779569 0.88 JAK2 (0.70) JAK2CDC7CDK1CDK2GSK3B
SCHEMBL27738546 0.88 JAK2 (0.70) JAK2CDC7CDK1CDK2GSK3B
SCHEMBL27759277 0.87 JAK2 (0.64) JAK2CDC7CDK1CDK2GSK3B
SCHEMBL27928062 0.85 JAK2 (0.71) JAK2CDC7CDK1CDK2GSK3B

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-A Pyridyl-and pyrimidinyl-substituted pyrrole-, thiophene-and furan-derivatives as kinase inhibitors NERVIANO MEDICAL SCIENCES SRL (IT) 2009-04-15 CN claimed
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