SCHEMBL5203965

SCHEMBL5203965

Cc1c[nH]c(C)c1-c1ccnc(Nc2cccc(O)c2)n1

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CDK2 P24941 8/20 0.69
CDK4 P11802 6/20 0.69
PLK1 P53350 4/20 0.54
KDR P35968 1/20 0.54
PTK2 Q05397 1/20 0.54
AURKB Q96GD4 1/20 0.54
SYK P43405 6/20 0.54
CDK1 P06493 2/20 0.48
CCNB1 P14635 2/20 0.48
CCNT1 O60563 1/20 0.48
CCNA2 P20248 1/20 0.48
CDK7 P50613 1/20 0.48
CDK9 P50750 1/20 0.48
CCNH P51946 1/20 0.48
CCNA1 P78396 1/20 0.48
EIF2AK2 P19525 2/20 0.48
CCNB2 O95067 1/20 0.48
RET P07949 1/20 0.48
CCNB3 Q8WWL7 1/20 0.48
SRC P12931 1/20 0.46

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
SCHEMBL5200887 0.86 CDK2 (0.69) CDK2CDK4PLK1CDK1CCNB1
SCHEMBL5201943 0.85 CDK4 (0.60) CDK2CDK4PLK1KDRPTK2
SCHEMBL5203806 0.83 CDK2 (0.65) CDK2CDK4KDR
SCHEMBL5206934 0.81 CDK2 (1.00) CDK2CDK4PLK1AURKBCDK1
SCHEMBL5201023 0.80 EIF2AK2 (0.63) CDK2CDK4EIF2AK2
SCHEMBL5201197 0.80 CDK2 (0.60) CDK2CDK4SYKEIF2AK2SRC
SCHEMBL4737537 0.79 SYK (0.67) CDK2CDK4PLK1KDRPTK2
SCHEMBL5200962 0.78 EIF2AK2 (0.61) CDK2CDK4PLK1KDRPTK2
SCHEMBL4614605 0.78 CDK2 (0.63) CDK2CDK4SYKCDK1CCNB1
SCHEMBL5206202 0.78 CDK2 (0.58) CDK2CDK4PLK1AURKBCDK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-100519553-C Inhiitors of cyclin dependent kinases as anti-cancer agent CYCLACEL LTD (GB) 2009-07-29 CN claimed
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
CN-1503794-A Inhiitors of cyclin dependent kinases as anti-cancer agent 2004-06-09 CN claimed
CN-100519553-C Inhiitors of cyclin dependent kinases as anti-cancer agent CYCLACEL LTD (GB) 2009-07-29 CN disclosed
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
CN-1503794-A Inhiitors of cyclin dependent kinases as anti-cancer agent 2004-06-09 CN 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 5/4885PLK1 54/4885
US-20040132746-A1 Inhibitors of cyclin dependent kinases as anti-cancer agent CDK2, CCNK, CDK3 CDK2 1/4885CDK4 5/4885PLK1 54/4885

“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.