SCHEMBL7087770

SCHEMBL7087770

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

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 14/20 0.67
MAPK13 O15264 7/20 0.67
MAPK12 P53778 7/20 0.67
MAPK11 Q15759 7/20 0.67
MAPK9 P45984 2/20 0.67
RAF1 P04049 1/20 0.67
BRD4 O60885 1/20 0.56
GCGR P47871 6/20 0.53
GSK3B P49841 2/20 0.53
ALOX5 P09917 2/20 0.53
PRKD3 O94806 1/20 0.53
MAP4K4 O95819 1/20 0.53
LCK P06239 1/20 0.53
RET P07949 1/20 0.53
PRKACA P17612 1/20 0.53
RPS6KB1 P23443 1/20 0.53
MATK P42679 1/20 0.53
FRK P42685 1/20 0.53
CSNK1A1 P48729 1/20 0.53
CSNK1D P48730 1/20 0.53

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
SCHEMBL10989572 0.92 KDM4E (0.60) MAPK14MAPK13MAPK12MAPK11MAPK9
SCHEMBL10992179 0.88 MAPK14 (0.83) MAPK14MAPK13MAPK12MAPK11MAPK9
Hydrochloric Acid SCHEMBL30023185 0.86 MAPK14 (0.80) MAPK14MAPK13MAPK12MAPK11MAPK9
SCHEMBL10892821 0.85 KDM4E (0.73) MAPK14MAPK13MAPK12MAPK11MAPK9
SCHEMBL8815338 0.82 MAPK14 (0.47) MAPK14MAPK13MAPK12MAPK11MAPK9
SCHEMBL6423292 0.80 MAPK14 (1.00) MAPK14MAPK13MAPK12MAPK11MAPK9
SCHEMBL4434902 0.80 MAPK14 (1.00) MAPK14MAPK13MAPK12MAPK11MAPK9
SCHEMBL11265026 0.77 MAPK14 (0.61) MAPK14MAPK13MAPK12MAPK11MAPK9
SCHEMBL5698694 0.77 MAPK14 (0.61) MAPK14MAPK13MAPK12MAPK11MAPK9
SCHEMBL7090083 0.75 MAPK14 (0.65) MAPK14MAPK13MAPK12MAPK11MAPK9

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-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
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.