SCHEMBL22419601

SCHEMBL22419601

CCOc1cc2ncc(C#N)c(Nc3cccc(C#N)c3)c2cc1N

nearest known ligand 0.71

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
EGFR P00533 14/20 0.71
ERBB2 P04626 12/20 0.71
GAK O14976 2/20 0.63
STK4 Q13043 5/20 0.58
SRC P12931 1/20 0.54

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
SCHEMBL2131741 0.94 EGFR (0.72) EGFRERBB2GAKSTK4SRC
SCHEMBL29670932 0.94 EGFR (0.72) EGFRERBB2GAKSTK4SRC
SCHEMBL30132269 0.94 EGFR (0.72) EGFRERBB2GAKSTK4SRC
SCHEMBL1897571 0.89 EGFR (0.85) EGFRERBB2GAKSTK4
SCHEMBL20584416 0.89 EGFR (0.71) EGFRERBB2GAKSTK4SRC
SCHEMBL2943166 0.86 EGFR (0.85) EGFRERBB2GAKSRC
SCHEMBL28046215 0.84 STK4 (0.61) EGFRERBB2STK4
SCHEMBL3593063 0.84 EGFR (0.86) EGFRERBB2GAKSRC
SCHEMBL28547159 0.84 STK4 (0.70) EGFRERBB2STK4SRC
SCHEMBL22419673 0.83 STK4 (0.84) EGFRERBB2STK4

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-10774068-B2 Composition and methods for inhibiting mammalian sterile 20-like kinase 1 THE SCRIPPS RESEARCH INSTITUTE (US) 2020-09-15 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-10774068-B2 Composition and methods for inhibiting mammalian sterile 20-like kinase 1 TESK2, TESK1, PRKACB EGFR 3953/4885ERBB2 3266/4885GAK 756/4885

“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.