SCHEMBL4160769

SCHEMBL4160769

CCNc1nc(C)c(-c2ccnc(Nc3ccc(OC)cc3C)n2)s1

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MKNK2 Q9HBH9 13/20 0.66
FLT3 P36888 10/20 0.66
MKNK1 Q9BUB5 4/20 0.66
AURKA O14965 5/20 0.65
CDK9 P50750 5/20 0.65
AURKB Q96GD4 5/20 0.65
CDK2 P24941 4/20 0.65
CDK7 P50613 4/20 0.65
CDK1 P06493 3/20 0.65
CDK4 P11802 3/20 0.52
WEE1 P30291 2/20 0.52
ALK Q9UM73 2/20 0.52
OPRM1 P35372 1/20 0.50
CHEK1 O14757 1/20 0.49
DAPK3 O43293 1/20 0.49
JAK2 O60674 1/20 0.49
PRKD3 O94806 1/20 0.49
MAP4K4 O95819 1/20 0.49
PAK4 O96013 1/20 0.49
ABL1 P00519 1/20 0.49

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
SCHEMBL4161732 0.92 AURKA (0.65) MKNK2FLT3MKNK1AURKACDK9
SCHEMBL4170533 0.85 MKNK2 (0.64) MKNK2FLT3MKNK1AURKACDK9
SCHEMBL4171151 0.85 CDK2 (0.78) MKNK2FLT3MKNK1AURKACDK9
SCHEMBL4803155 0.84 CDK2 (0.71) MKNK2FLT3MKNK1AURKACDK9
SCHEMBL4165787 0.80 CDK2 (0.77) MKNK2FLT3MKNK1AURKACDK9
SCHEMBL4161891 0.79 CDK2 (0.80) MKNK2FLT3AURKACDK9AURKB
SCHEMBL4154625 0.79 CDK2 (1.00) MKNK2FLT3MKNK1AURKACDK9
SCHEMBL2286993 0.78 MKNK2 (0.85) MKNK2FLT3MKNK1AURKACDK9
SCHEMBL5621065 0.77 CDK2 (0.69) MKNK2FLT3MKNK1AURKACDK9
SCHEMBL4158859 0.77 MKNK2 (0.61) MKNK2FLT3MKNK1AURKACDK9

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 MKNK2 330/4885FLT3 618/4885MKNK1 283/4885

“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.