SCHEMBL5206401

SCHEMBL5206401

Cc1c[nH]c(C)c1-c1ccnc(Nc2ccc(I)c(Cl)c2)n1

nearest known ligand 0.58

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CDK2 P24941 9/20 0.58
CDK4 P11802 8/20 0.58
EIF2AK2 P19525 6/20 0.44
PIK3C3 Q8NEB9 1/20 0.41
PIK3CA P42336 1/20 0.41
PIK3CB P42338 1/20 0.41
PIK3CG P48736 1/20 0.41
PLK1 P53350 2/20 0.41
KDR P35968 1/20 0.41
PTK2 Q05397 1/20 0.41
AURKB Q96GD4 1/20 0.41
CAMK2D Q13557 1/20 0.40

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
SCHEMBL5202628 0.87 CDK2 (0.58) CDK2CDK4EIF2AK2
SCHEMBL5200962 0.83 EIF2AK2 (0.61) CDK2CDK4EIF2AK2PIK3CAPIK3CB
SCHEMBL5206202 0.83 CDK2 (0.58) CDK2CDK4EIF2AK2PLK1AURKB
SCHEMBL5200887 0.82 CDK2 (0.69) CDK2CDK4EIF2AK2PIK3CAPIK3CB
SCHEMBL5200728 0.82 GSK3B (0.55) CDK2CDK4
SCHEMBL5201023 0.81 EIF2AK2 (0.63) CDK2CDK4EIF2AK2
SCHEMBL5201943 0.79 CDK4 (0.60) CDK2CDK4EIF2AK2PLK1KDR
SCHEMBL4614605 0.79 CDK2 (0.63) CDK2CDK4EIF2AK2PIK3CAPIK3CB
SCHEMBL5201243 0.78 PIK3CG (0.63) CDK2CDK4EIF2AK2PIK3CAPIK3CB
SCHEMBL5201197 0.78 CDK2 (0.60) CDK2CDK4EIF2AK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7262202-B2 Inhibitors of cyclin dependent kinases as anti-cancer agent CYCLACEL LIMITED (GB) 2007-08-28 US claimed
US-20070185134-A1 Inhibitors of cyclin dependent kinases as anti-cancer agent CYCLACEL LIMITED (GB) 2007-08-09 US claimed
EP-1373253-B1 INHIBITORS OF CYCLIN DEPENDENT KINASES AS ANTI-CANCER AGENT CYCLACEL LTD (GB) 2007-06-20 EP claimed
US-20040132746-A1 Inhibitors of cyclin dependent kinases as anti-cancer agent CYCLACEL LIMITED (GB) 2004-07-08 US claimed
US-7262202-B2 Inhibitors of cyclin dependent kinases as anti-cancer agent CYCLACEL LIMITED (GB) 2007-08-28 US disclosed
US-20070185134-A1 Inhibitors of cyclin dependent kinases as anti-cancer agent CYCLACEL LIMITED (GB) 2007-08-09 US disclosed
US-20040132746-A1 Inhibitors of cyclin dependent kinases as anti-cancer agent CYCLACEL LIMITED (GB) 2004-07-08 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 (2 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-20070185134-A1 Inhibitors of cyclin dependent kinases as anti-cancer agent CDK2, CCNK, CDK3 CDK2 1/4885CDK4 5/4885EIF2AK2 831/4885
US-20040132746-A1 Inhibitors of cyclin dependent kinases as anti-cancer agent CDK2, CCNK, CDK3 CDK2 1/4885CDK4 5/4885EIF2AK2 831/4885

“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.