SCHEMBL6071940

SCHEMBL6071940

CC(C)(C)n1cc(CNc2cc(Cl)c3ncc(C#N)c(Nc4ccc(F)c(Cl)c4)c3c2)nn1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
MAP3K8 P41279 20/20 1.00
EGFR P00533 1/20 0.69
SRC P12931 1/20 0.69
MAPKAPK2 P49137 1/20 0.69

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
SCHEMBL27728076 0.94 MAP3K8 (1.00) MAP3K8EGFRSRCMAPKAPK2
SCHEMBL4961615 0.90 MAP3K8 (0.82) MAP3K8EGFRSRCMAPKAPK2
SCHEMBL27707476 0.87 MAP3K8 (0.84) MAP3K8
SCHEMBL27707358 0.86 MAP3K8 (0.80) MAP3K8EGFRSRC
SCHEMBL27728235 0.86 MAP3K8 (0.84) MAP3K8
SCHEMBL4960561 0.85 MAP3K8 (1.00) MAP3K8EGFRSRCMAPKAPK2
SCHEMBL27728161 0.85 MAP3K8 (1.00) MAP3K8
SCHEMBL27707365 0.85 MAP3K8 (0.83) MAP3K8
SCHEMBL27728147 0.85 MAP3K8 (1.00) MAP3K8
SCHEMBL4960621 0.85 MAP3K8 (1.00) MAP3K8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101223143-A 3-cyanoquinoline inhibitors of TPL2 kinase and methods of making and using the same WYETH CORP (US) 2008-07-16 CN 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

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 84/4885EGFR 4122/4885SRC 1670/4885

“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.