SCHEMBL6911490

SCHEMBL6911490

Cc1[nH]c([N+](=O)[O-])c(C)c1-c1ccnc(Nc2ccccc2)n1

nearest known ligand 0.80

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CDK2 P24941 13/20 0.80
CDK4 P11802 11/20 0.80
EIF2AK2 P19525 5/20 0.53
ABL1 P00519 2/20 0.47
PRKCA P17252 2/20 0.47
BCR P11274 1/20 0.47
EGFR P00533 1/20 0.46
PRKCD Q05655 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
SCHEMBL4614634 0.89 CDK2 (1.00) CDK2CDK4EIF2AK2
SCHEMBL4613772 0.87 CDK2 (0.77) CDK2CDK4EIF2AK2
SCHEMBL4615045 0.81 CDK2 (0.68) CDK2CDK4EIF2AK2
SCHEMBL4613380 0.78 CDK2 (0.76) CDK2CDK4EIF2AK2ABL1PRKCA
SCHEMBL4614974 0.77 CDK2 (0.75) CDK2CDK4EIF2AK2ABL1PRKCA
SCHEMBL13239592 0.75 EIF2AK2 (0.67) CDK2CDK4EIF2AK2ABL1PRKCA
SCHEMBL4613817 0.74 CDK2 (1.00) CDK2CDK4ABL1PRKCABCR
SCHEMBL8316804 0.74 CDK4 (0.59) CDK2CDK4EIF2AK2
SCHEMBL8316906 0.73 CDK4 (0.58) CDK2CDK4EIF2AK2
SCHEMBL8320692 0.72 CDK2 (0.57) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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 (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-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.