SCHEMBL7090769

SCHEMBL7090769

CSc1ccc(-c2nc(C(F)(F)F)[nH]c2-c2ccc(F)cc2)cc1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 14/20 0.61
MAPK13 O15264 10/20 0.61
MAPK12 P53778 10/20 0.61
MAPK11 Q15759 10/20 0.61
GCGR P47871 7/20 0.61
ALOX5 P09917 3/20 0.61
PRKD3 O94806 2/20 0.61
MAP4K4 O95819 2/20 0.61
FRK P42685 2/20 0.61
MAPK9 P45984 2/20 0.61
CSNK1A1 P48729 2/20 0.61
CSNK1D P48730 2/20 0.61
GSK3B P49841 2/20 0.61
PRKD2 Q9BZL6 2/20 0.61
CLK4 Q9HAZ1 2/20 0.61
LCK P06239 1/20 0.61
RET P07949 1/20 0.61
PRKACA P17612 1/20 0.61
RPS6KB1 P23443 1/20 0.61
MATK P42679 1/20 0.61

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
SCHEMBL7087963 0.89 ESR1 (0.68) MAPK14MAPK13MAPK12MAPK11GCGR
SCHEMBL7090556 0.89 ESR1 (0.53) MAPK14MAPK13MAPK12MAPK11GCGR
SCHEMBL9005989 0.88 ESR1 (0.65) MAPK14MAPK13MAPK12MAPK11GCGR
SCHEMBL7085276 0.88 ESR1 (0.52) MAPK14MAPK13MAPK12MAPK11GCGR
SCHEMBL7089423 0.88 ESR1 (0.52) MAPK14MAPK13MAPK12MAPK11GCGR
SCHEMBL11087416 0.87 MAPK14 (0.56) MAPK14MAPK13MAPK12MAPK11GCGR
SCHEMBL7089213 0.85 ESR1 (0.50) MAPK14MAPK13MAPK12MAPK11GCGR
SCHEMBL7084462 0.85 ESR1 (0.47) MAPK14MAPK13MAPK12MAPK11GCGR
SCHEMBL7087966 0.85 MAPK14 (0.46) MAPK14MAPK13MAPK12MAPK11GCGR
SCHEMBL7088586 0.83 PTGS1 (0.58) MAPK14MAPK11ALOX5CSNK1A1CSNK1D

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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 MAPK14 1523/4885MAPK13 2251/4885MAPK12 2078/4885

“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.