SCHEMBL4960478

SCHEMBL4960478

Cn1cnc(CNc2cc(Cl)c3ncc(C#N)c(Nc4ccc(F)c(Cl)c4)c3c2)c1

nearest known ligand 0.88

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MAP3K8 P41279 20/20 0.88
LCK P06239 1/20 0.88
CYP3A4 P08684 1/20 0.88
RPS6KB1 P23443 1/20 0.88
MAPK8 P45983 1/20 0.88
MAPKAPK2 P49137 1/20 0.88
EGFR P00533 1/20 0.70

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
SCHEMBL2278592 0.93 MAP3K8 (1.00) MAP3K8LCKCYP3A4RPS6KB1MAPK8
SCHEMBL4961615 0.87 MAP3K8 (0.82) MAP3K8MAPKAPK2EGFR
SCHEMBL6071940 0.84 MAP3K8 (1.00) MAP3K8MAPKAPK2EGFR
SCHEMBL4964645 0.84 MAP3K8 (0.81) MAP3K8LCKCYP3A4RPS6KB1MAPK8
SCHEMBL4964129 0.83 MAP3K8 (0.75) MAP3K8CYP3A4RPS6KB1MAPKAPK2EGFR
SCHEMBL27728235 0.83 MAP3K8 (0.84) MAP3K8
SCHEMBL4960489 0.83 MAP3K8 (1.00) MAP3K8CYP3A4MAPKAPK2EGFR
SCHEMBL6071095 0.83 MAP3K8 (0.72) MAP3K8CYP3A4RPS6KB1MAPKAPK2EGFR
SCHEMBL27728096 0.82 MAP3K8 (0.78) MAP3K8CYP3A4RPS6KB1MAPKAPK2EGFR
SCHEMBL27707302 0.82 MAP3K8 (1.00) MAP3K8CYP3A4RPS6KB1MAPKAPK2EGFR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1888529-A2 3-CYANOQUINOLINE INHIBITORS OF TPL2 KINASE AND METHODS OF MAKING AND USING THE SAME Wyeth (US) 2008-02-20 EP disclosed
US-20060264460-A1 3-Cyanoquinoline inhibitors of Tpl2 kinase and methods of making and using the same WYETH (US) 2006-11-23 US disclosed
WO-2006124692-A2 3-CYANOQUINOLINE INHIBITORS OF TPL2 KINASE AND METHODS OF MAKING AND USING THE SAME WYETH (US) 2006-11-23 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-20060264460-A1 3-Cyanoquinoline inhibitors of Tpl2 kinase and methods of making and using the same TNNI3K, CSNK1A1L, CDKL1 MAP3K8 84/4885LCK 296/4885CYP3A4 2706/4885

“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.