SCHEMBL4157090

SCHEMBL4157090

Cc1nc(-c2cccnc2)sc1-c1ccnc(Nc2ccc3c(c2)OCO3)n1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CLK1 P49759 4/20 0.57
DYRK1A Q13627 4/20 0.57
CLK4 Q9HAZ1 4/20 0.57
DYRK1B Q9Y463 4/20 0.57
CLK2 P49760 3/20 0.57
CDK2 P24941 12/20 0.52
CDK4 P11802 11/20 0.52
ABL1 P00519 1/20 0.48
BCR P11274 1/20 0.48
CLK3 P49761 1/20 0.48
PRKCA P17252 1/20 0.47
NPC1 O15118 1/20 0.47
LMNA P02545 1/20 0.47
TP53 P04637 1/20 0.47
POLB P06746 1/20 0.47
MAPT P10636 1/20 0.47
RAB9A P51151 1/20 0.47
AURKA O14965 1/20 0.47
CDK1 P06493 1/20 0.47
CDK7 P50613 1/20 0.47

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
SCHEMBL4164507 0.94 CDK4 (0.52) CLK1DYRK1ACLK4DYRK1BCLK2
SCHEMBL27720404 0.82 CDK2 (0.67) CDK2CDK4ABL1BCRPRKCA
SCHEMBL4161949 0.81 CDK2 (0.64) CLK1DYRK1ACLK4DYRK1BCLK2
SCHEMBL6156440 0.81 CDK2 (0.67) CDK2CDK4ABL1BCRPRKCA
SCHEMBL5162379 0.81 ABL1 (0.45) CDK2CDK4ABL1BCRPRKCA
SCHEMBL4170636 0.80 PRKCA (0.54) CDK2CDK4ABL1BCRPRKCA
SCHEMBL4171125 0.80 CDK2 (0.64) CLK1DYRK1ACLK4DYRK1BCLK2
SCHEMBL12278950 0.80 CDK2 (0.51) CDK2CDK4ABL1BCRPRKCA
SCHEMBL4164771 0.79 ZAP70 (0.54) DYRK1ACLK2CDK2CDK4ABL1
SCHEMBL4173509 0.79 CDK2 (0.71) CLK1DYRK1ACLK4DYRK1BCLK2

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 6 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

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 CLK1 647/4885DYRK1A 452/4885CLK4 682/4885

“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.