SCHEMBL4458835

SCHEMBL4458835

CSc1nc(-c2ccnc(Sc3ccccc3)c2)c(-c2ccc(F)cc2)[nH]1

nearest known ligand 0.71

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 20/20 0.71
MAPK13 O15264 12/20 0.71
MAPK12 P53778 12/20 0.71
MAPK11 Q15759 12/20 0.71
EGFR P00533 1/20 0.67
KCNH2 Q12809 1/20 0.67

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
SCHEMBL4464542 0.88 MAPK14 (0.81) MAPK14MAPK13MAPK12MAPK11EGFR
SCHEMBL4462251 0.83 MAPK14 (1.00) MAPK14MAPK13MAPK12MAPK11EGFR
SCHEMBL4464121 0.83 MAPK14 (1.00) MAPK14MAPK13MAPK12MAPK11EGFR
SCHEMBL13712660 0.81 MAPK14 (0.83) MAPK14MAPK13MAPK12MAPK11EGFR
SCHEMBL4466708 0.81 MAPK14 (0.78) MAPK14MAPK13MAPK12MAPK11EGFR
SCHEMBL4464551 0.80 MAPK14 (0.79) MAPK14MAPK13MAPK12MAPK11EGFR
SCHEMBL4462832 0.80 MAPK14 (0.79) MAPK14MAPK13MAPK12MAPK11EGFR
SCHEMBL3231109 0.80 MAPK14 (0.92) MAPK14MAPK13MAPK12MAPK11EGFR
SCHEMBL4459233 0.79 MAPK14 (0.76) MAPK14MAPK13MAPK12MAPK11
SCHEMBL4458810 0.79 MAPK14 (1.00) MAPK14MAPK13MAPK12MAPK11EGFR

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 3841/4885MAPK13 3803/4885MAPK12 3533/4885

“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.