SCHEMBL4463032

SCHEMBL4463032

CS(=O)(=O)c1ccc(CSc2nc(-c3ccc(F)cc3)c(-c3cccnc3)[nH]2)cc1

nearest known ligand 0.63

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 7/20 0.63
PTGS1 P23219 6/20 0.63
MAPK14 Q16539 12/20 0.58
MAPK11 Q15759 8/20 0.56
MAPK13 O15264 7/20 0.56
MAPK12 P53778 7/20 0.56
ALDH1A1 P00352 1/20 0.51
ALOX5 P09917 1/20 0.51
CSNK1A1 P48729 1/20 0.51
CSNK1D P48730 1/20 0.51
CSNK1E P49674 1/20 0.51
SMN1; SMN2 Q16637 1/20 0.51
CSNK1A1L Q8N752 1/20 0.51

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
SCHEMBL6581506 0.88 MAPK14 (0.72) PTGS2PTGS1MAPK14MAPK11MAPK13
SCHEMBL7090797 0.86 PTGS1 (0.74) PTGS2PTGS1MAPK14MAPK11MAPK13
SCHEMBL4471588 0.85 MAPK14 (0.63) MAPK14MAPK11MAPK13MAPK12ALOX5
SCHEMBL4466262 0.85 MAPK14 (0.58) MAPK14MAPK11MAPK13MAPK12
SCHEMBL4464495 0.82 MAPK14 (0.70) PTGS2PTGS1MAPK14MAPK11MAPK13
SCHEMBL7085138 0.81 PTGS1 (0.78) PTGS2PTGS1MAPK14MAPK11MAPK13
SCHEMBL6581503 0.81 PTGS1 (0.60) PTGS2PTGS1MAPK14MAPK11MAPK13
SCHEMBL5698659 0.79 ALOX5 (0.75) PTGS2PTGS1MAPK14MAPK11MAPK13
SCHEMBL6582452 0.78 MAPK14 (0.72) PTGS2PTGS1MAPK14MAPK11MAPK13
SCHEMBL4468187 0.78 MAPK14 (0.71) PTGS2PTGS1MAPK14MAPK11MAPK13

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-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 PTGS2 28/4885PTGS1 36/4885MAPK14 3841/4885

“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.