SCHEMBL4463040

SCHEMBL4463040

CSc1nc(-c2ccnc(Nc3cccc(C)c3)c2)c(-c2ccc(F)cc2)[nH]1

nearest known ligand 0.81

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 15/20 0.81
EGFR P00533 6/20 0.81
MAPK13 O15264 4/20 0.81
MAPK12 P53778 4/20 0.81
MAPK11 Q15759 4/20 0.81
KCNH2 Q12809 1/20 0.81
MAPK10 P53779 1/20 0.72
GSK3B P49841 1/20 0.66

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
SCHEMBL4462745 0.89 MAPK14 (0.90) MAPK14EGFRMAPK13MAPK12MAPK11
SCHEMBL4455230 0.86 MAPK14 (0.92) MAPK14EGFRMAPK13MAPK12MAPK11
SCHEMBL4466880 0.84 MAPK14 (0.83) MAPK14EGFRGSK3B
SCHEMBL4458803 0.84 MAPK14 (0.81) MAPK14EGFRMAPK13MAPK12MAPK11
SCHEMBL4464110 0.83 MAPK14 (0.73) MAPK14EGFRMAPK13MAPK12MAPK11
SCHEMBL4464856 0.82 MAPK14 (0.78) MAPK14EGFRMAPK13MAPK12MAPK11
SCHEMBL4463795 0.81 MAPK14 (0.73) MAPK14EGFRMAPK13MAPK12MAPK11
SCHEMBL4477347 0.80 MAPK14 (1.00) MAPK14GSK3B
SCHEMBL13712682 0.80 MAPK14 (0.68) MAPK14EGFRMAPK13MAPK12MAPK11
SCHEMBL4471619 0.79 MAPK14 (1.00) MAPK14MAPK13MAPK12MAPK11

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7582660-B2 2-thio-substituted imidazole derivatives and their use in pharmaceutics C-A-I-R BIOSCIENCES GMBH (DE) 2009-09-01 US disclosed
US-7582660-B2 2-thio-substituted imidazole derivatives and their use in pharmaceutics C-A-I-R BIOSCIENCES GMBH (DE) 2009-09-01 US disclosed
US-7582660-B2 2-thio-substituted imidazole derivatives and their use in pharmaceutics C-A-I-R BIOSCIENCES GMBH (DE) 2009-09-01 US disclosed
US-20060235054-A1 2-Thio-substituted imidazole derivatives and their use in pharmaceutics MERCKLE-GMBH (DE) 2006-10-19 US disclosed
EP-1539741-A1 2-THIO-SUBSTITUTED IMIDAZOLE DERIVATIVES AND THEIR USE IN PHARMACEUTICS MERCKLE GMBH (DE) 2005-06-15 EP disclosed
WO-2004018458-A1 2-THIO-SUBSTITUTED IMIDAZOLE DERIVATIVES AND THEIR USE IN PHARMACEUTICS MERCKLE-GMBH (DE) 2004-03-04 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-20060235054-A1 2-Thio-substituted imidazole derivatives and their use in pharmaceutics IL2, TPMT, IFNG MAPK14 3841/4885EGFR 1611/4885MAPK13 3803/4885

“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.