SCHEMBL4775833

SCHEMBL4775833

N#Cc1cnc2cnc(F)cc2c1Nc1ccccc1

nearest known ligand 0.60

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
MAP2K1 Q02750 9/20 0.60
RAF1 P04049 5/20 0.54
EGFR P00533 5/20 0.54
ERBB2 P04626 5/20 0.54
MAP3K8 P41279 5/20 0.53
STK4 Q13043 1/20 0.50

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
SCHEMBL4766938 0.97 MAP2K1 (0.64) MAP2K1RAF1EGFRERBB2MAP3K8
SCHEMBL5110365 0.93 MAP2K1 (0.65) MAP2K1RAF1EGFRERBB2MAP3K8
SCHEMBL5114679 0.90 MAP2K1 (0.59) MAP2K1RAF1EGFRERBB2MAP3K8
SCHEMBL4777269 0.90 MAP2K1 (0.67) MAP2K1RAF1EGFRERBB2MAP3K8
SCHEMBL4775969 0.90 MAP2K1 (0.71) MAP2K1RAF1EGFRERBB2MAP3K8
SCHEMBL4776688 0.90 EGFR (0.67) MAP2K1RAF1EGFRERBB2MAP3K8
SCHEMBL5125249 0.89 EGFR (0.69) EGFRERBB2MAP3K8
SCHEMBL4777245 0.88 EGFR (0.65) EGFRERBB2MAP3K8
SCHEMBL4775895 0.88 MAP2K1 (0.70) MAP2K1RAF1EGFRERBB2MAP3K8
SCHEMBL4772326 0.88 MAP3K8 (0.60) MAP2K1RAF1EGFRERBB2MAP3K8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7432279-B2 4,6-diamino-[1,7]naphthyridine-3-carbonitrile inhibitors of Tpl2 kinase and methods of making and using the same WYETH (US) 2008-10-07 US disclosed
EP-1881981-A1 4, 6-DIAMINO-[1,7] NAPHTHYRIDINE-3-CARBONITRILE INHIBITORS OF TPL2 KINASE AND METHODS OF MAKING AND USING THE SAME Wyeth (US) 2008-01-30 EP disclosed
US-20060276498-A1 4,6-diamino-[1,7]naphthyridine-3-carbonitrile inhibitors of Tpl2 kinase and methods of making and using the same WYETH (US) 2006-12-07 US disclosed
WO-2006124944-A1 4, 6-DIAMINO-[1,7] NAPHTHYRIDINE-3-CARBONITRILE 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-20060276498-A1 4,6-diamino-[1,7]naphthyridine-3-carbonitrile inhibitors of Tpl2 kinase and methods of making and using the same TNNI3K, CNKSR1, DTYMK MAP2K1 416/4885RAF1 160/4885EGFR 2871/4885

“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.