SCHEMBL6604495

SCHEMBL6604495

CCCc1ncc(-c2ccnc(Nc3ccccc3)n2)[nH]1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PRKCD Q05655 2/20 0.49
ABL1 P00519 1/20 0.49
EGFR P00533 1/20 0.49
PRKCA P17252 1/20 0.49
CDK2 P24941 5/20 0.48
CDK4 P11802 4/20 0.48
CDC7 O00311 2/20 0.47
GSK3B P49841 2/20 0.46
DYRK1A Q13627 1/20 0.46
PIK3C3 Q8NEB9 2/20 0.45
CDK1 P06493 2/20 0.44
CCNB2 O95067 1/20 0.44
CCNB1 P14635 1/20 0.44
CCNB3 Q8WWL7 1/20 0.44
JAK2 O60674 1/20 0.44
JAK3 P52333 1/20 0.44
KDR P35968 1/20 0.44
PLK1 P53350 1/20 0.44
PTK2 Q05397 1/20 0.44
CHEK1 O14757 1/20 0.43

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
SCHEMBL6106023 0.81 CDK2 (0.56) PRKCDABL1EGFRPRKCACDK2
SCHEMBL6605419 0.81 PRKCD (0.47) PRKCDABL1EGFRPRKCACDK2
SCHEMBL5781715 0.80 PRKCD (0.51) PRKCDABL1EGFRPRKCACDK2
SCHEMBL6634935 0.80 PRKCD (0.44) PRKCDABL1EGFRPRKCACDK2
SCHEMBL8252390 0.79 PRKCD (0.45) PRKCDABL1EGFRPRKCACDK2
SCHEMBL6604551 0.77 CDC7 (0.41) PRKCDABL1EGFRPRKCACDK2
SCHEMBL5785122 0.75 PRKCD (0.46) PRKCDABL1EGFRPRKCACDK2
SCHEMBL6821948 0.75 CAMK2D (0.57) PRKCDABL1PRKCACDK2CDK4
SCHEMBL5785112 0.74 PRKCD (0.50) PRKCDABL1EGFRPRKCACDK2
SCHEMBL6634930 0.73 CDK2 (0.46) PRKCDABL1EGFRPRKCACDK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1490354-A1 4-IMIDAZOLYL SUBSTITUTED PYRIMIDINE DERIVATIVES WITH CDK INHIBITORY ACTIVITY Astrazeneca AB (SE) 2004-12-29 EP disclosed
EP-1487823-A1 DERIVATIVES OF 4-(IMIDAZOL-5-YL)-2-(4-SULFOANILINO)PYRIMIDINE WITH CDK INHIBITORY ACTIVITY AstraZeneca AB (SE) 2004-12-22 EP disclosed
WO-2003076436-A1 DERIVATIVES OF 4- (IMIDAZOL-5-YL)-2-(4-SULFOANILINO) PYRIMIDINE WITH CDK INHIBITORY ACTIVITY ASTRAZENECA AB (SE) 2003-09-18 WO disclosed
WO-2003076434-A1 4- IMIDAZOLYL SUBSTUITED PYRIMIDINE DERIVATIVES WITH CDK INHIBITIORY ACTIVITY ASTRAZENECA AB (SE) 2003-09-18 WO disclosed