SCHEMBL7090966

SCHEMBL7090966

NS(=O)(=O)c1ccc(-c2nc(SCc3ccccc3)[nH]c2-c2ccc(Cl)cc2)cc1

nearest known ligand 0.64

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 5/20 0.58
PTGS1 P23219 4/20 0.58
MAPK14 Q16539 5/20 0.55
MAPK13 O15264 2/20 0.53
MAPK12 P53778 2/20 0.53
MAPK11 Q15759 2/20 0.53
CTSB P07858 1/20 0.51
MEN1 O00255 2/20 0.50
KMT2A Q03164 2/20 0.50
POLB P06746 1/20 0.50
LMNA P02545 2/20 0.47
ALDH1A1 P00352 1/20 0.47
HTT P42858 1/20 0.47
DRD2 P14416 1/20 0.47
MAOB P27338 1/20 0.46

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
SCHEMBL7089496 0.93 PTGS1 (0.61) PTGS2PTGS1MAPK14MAPK13MAPK12
SCHEMBL7084156 0.89 PTGS1 (0.74) PTGS2PTGS1MAPK14MAPK13MAPK12
SCHEMBL7087719 0.89 MAPK14 (0.71) PTGS2PTGS1MAPK14MAPK13MAPK12
SCHEMBL7085138 0.82 PTGS1 (0.78) PTGS2PTGS1MAPK14MAPK13MAPK12
SCHEMBL7085202 0.81 CA12 (0.50) PTGS2PTGS1MAPK14MAPK13MAPK12
SCHEMBL7087491 0.80 PTGS2 (0.47) PTGS2PTGS1MEN1KMT2APOLB
SCHEMBL7085305 0.80 MAPK13 (0.54) PTGS2PTGS1MAPK14MAPK13MAPK12
SCHEMBL9665340 0.79 MAPK14 (0.71) MAPK14MAPK13MAPK12MAPK11LMNA
SCHEMBL6581592 0.79 MAPK14 (0.72) PTGS2PTGS1MAPK14MAPK13MAPK12
SCHEMBL4468187 0.79 MAPK14 (0.71) PTGS2PTGS1MAPK14MAPK13MAPK12

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5620999-A ANTIARTHRITIC, ANALGESIC AND ANTIPYRATIC AGENT G.D. SEARLE & CO. 1997-04-15 US claimed
US-20030050330-A1 4,5-subtstituted imdazolyl compounds for the treatment of inflammation G.D. SEARLE & CO. 2003-03-13 US disclosed
EP-0772601-B1 4,5-SUBSTITUTED IMIDAZOLYL COMPOUNDS FOR THE TREATMENT OF INFLAMMATION SEARLE & CO (US) 2002-09-18 EP disclosed
US-6426360-B1 ANTIARTHRITIC AGENTS G D SEARLE & CO. 2002-07-30 US disclosed
EP-1211244-A2 4,5-substitued imidazolyl compounds for the treatment of inflammation G.D. Searle & Co. (US) 2002-06-05 EP disclosed
EP-0772601-A1 4,5-SUBSTITUTED IMIDAZOLYL COMPOUNDS FOR THE TREATMENT OF INFLAMMATION G.D. SEARLE & CO. (US) 1997-05-14 EP disclosed
US-5620999-A ANTIARTHRITIC, ANALGESIC AND ANTIPYRATIC AGENT G.D. SEARLE & CO. 1997-04-15 US disclosed
WO-1996003387-A1 4,5-SUBSTITUTED IMIDAZOLYL COMPOUNDS FOR THE TREATMENT OF INFLAMMATION G.D. SEARLE & CO. (US) 1996-02-08 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-20030050330-A1 4,5-subtstituted imdazolyl compounds for the treatment of inflammation AHR, HACL2, IRAK2 PTGS2 122/4885PTGS1 114/4885MAPK14 1523/4885

“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.