SCHEMBL4354030

SCHEMBL4354030

N[N+]12C=CN=CC1=C(C1=CC=C1)N=C2c1ccc(C(=O)c2ccccc2)c(Cl)c1

nearest known ligand 0.33

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MAPK13 O15264 1/20 0.33
MAPK12 P53778 1/20 0.33
MAPK11 Q15759 1/20 0.33
MAPK14 Q16539 1/20 0.33
TNK2 Q07912 3/20 0.32
ALOX15 P16050 2/20 0.32
CHEK2 O96017 1/20 0.30

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
SCHEMBL1129530 0.90 MAPT (0.33) TNK2
SCHEMBL4357642 0.89 TNK2 (0.32) TNK2
SCHEMBL4365479 0.87 TNK2 (0.34) MAPK14TNK2ALOX15CHEK2
SCHEMBL4365532 0.86 MEN1 (0.33) CHEK2
SCHEMBL4358853 0.86 TNK2 (0.35) TNK2
SCHEMBL4357785 0.83 ALOX15 (0.34) TNK2ALOX15
SCHEMBL4364741 0.82
SCHEMBL4356214 0.81 KMT2A (0.31) TNK2
SCHEMBL4361177 0.80 CYP1A2 (0.32) TNK2
SCHEMBL2462686 0.79

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
US-8481733-B2 Substituted imidazopyr- and imidazotri-azines OSI Pharmaceuticals, LLC (US) 2013-07-09 US disclosed
EP-2283020-B1 SUBSTITUTED IMIDAZOPYR-AND IMIDAZOTRI-AZINES OSI PHARM INC (US) 2012-10-31 EP disclosed
US-20090286768-A1 SUBSTITUTED IMIDAZOPYR- AND IMIDAZOTRI-AZINES OSI PHARMACEUTICALS, INC. (US) 2009-11-19 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-20090286768-A1 SUBSTITUTED IMIDAZOPYR- AND IMIDAZOTRI-AZINES ABL1, TPMT, CYP2C19 MAPK13 1098/4885MAPK12 1092/4885MAPK11 1595/4885

“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.