SCHEMBL4160392

SCHEMBL4160392

Cc1nc(-c2cccnc2)sc1-c1ccnc(Nc2cc(Cl)c(N3CCOCC3)c(Cl)c2)n1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CDK2 P24941 12/20 0.59
CDK9 P50750 8/20 0.59
CCNA2 P20248 6/20 0.59
CCNT1 O60563 5/20 0.59
CDK4 P11802 6/20 0.56
AURKA O14965 5/20 0.56
AURKB Q96GD4 5/20 0.56
CDK1 P06493 5/20 0.56
ACVR1 Q04771 4/20 0.52
ABL1 P00519 4/20 0.52
CDK6 Q00534 3/20 0.52
MAPK8 P45983 3/20 0.52
JAK2 O60674 3/20 0.52
CAMK2D Q13557 2/20 0.52
BCR P11274 2/20 0.52
MAPK10 P53779 2/20 0.52
CHEK1 O14757 2/20 0.52
DAPK3 O43293 2/20 0.52
PRKD3 O94806 2/20 0.52
PAK4 O96013 2/20 0.52

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
SCHEMBL4173630 0.91 CDK2 (0.55) CDK2CDK9CCNA2CCNT1CDK4
SCHEMBL4173509 0.87 CDK2 (0.71) CDK2CDK9CCNA2CCNT1CDK4
SCHEMBL4163541 0.85 CDK2 (0.73) CDK2CDK9CCNA2CCNT1CDK4
SCHEMBL4167335 0.84 CDK2 (0.59) CDK2CDK9CCNA2CCNT1CDK4
SCHEMBL4154831 0.83 CDK2 (0.77) CDK2CDK9CCNA2CCNT1CDK4
SCHEMBL4170629 0.82 IGF1R (0.53) CDK2CDK9CCNA2CCNT1CDK4
SCHEMBL4176513 0.80 CDK2 (0.60) CDK2CDK9CCNA2CCNT1CDK4
SCHEMBL4164505 0.78 CDK2 (0.58) CDK2CDK9CCNA2CCNT1CDK4
SCHEMBL4160087 0.78 CDK2 (0.71) CDK2CDK9CCNA2CCNT1CDK4
SCHEMBL27720404 0.78 CDK2 (0.67) CDK2CDK9CCNA2CDK4AURKA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090137572-A1 2-substituted-4-heteroaryl-pyrimidines useful for the treatment of proliferative disorders CYCLACEL LIMITED (GB) 2009-05-28 US claimed
EP-1756098-A2 2-SUBSTITUTED-4-HETEROARYL-PYRIMIDINES USEFUL FOR THE TREATMENT OF PROLIFERATIVE DISORDERS Cyclacel Limited (GB) 2007-02-28 EP claimed
WO-2005116025-A2 2-SUBSTITUTED-4-HETEROARYL-PYRIMIDINES USEFUL FOR THE TREATMENT OF PROLIFERATIVE DISORDERS CYCLACEL LIMITED (GB) 2005-12-08 WO claimed
US-20090137572-A1 2-substituted-4-heteroaryl-pyrimidines useful for the treatment of proliferative disorders CYCLACEL LIMITED (GB) 2009-05-28 US disclosed
US-20090137572-A1 2-substituted-4-heteroaryl-pyrimidines useful for the treatment of proliferative disorders CYCLACEL LIMITED (GB) 2009-05-28 US disclosed
US-20090137572-A1 2-substituted-4-heteroaryl-pyrimidines useful for the treatment of proliferative disorders CYCLACEL LIMITED (GB) 2009-05-28 US disclosed
EP-1756098-A2 2-SUBSTITUTED-4-HETEROARYL-PYRIMIDINES USEFUL FOR THE TREATMENT OF PROLIFERATIVE DISORDERS Cyclacel Limited (GB) 2007-02-28 EP disclosed
WO-2005116025-A2 2-SUBSTITUTED-4-HETEROARYL-PYRIMIDINES USEFUL FOR THE TREATMENT OF PROLIFERATIVE DISORDERS CYCLACEL LIMITED (GB) 2005-12-08 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20090137572-A1 2-substituted-4-heteroaryl-pyrimidines useful for the treatment of proliferative disorders CDK2, CDK4, CDK20 CDK2 1/4885CDK9 34/4885CCNA2 25/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.