SCHEMBL5837591

SCHEMBL5837591

Cc1cccc(-c2nn(CC(=O)OC(C)(C)C)cc2-c2ccc3c(c2)n(C)c(=O)n3C)c1

nearest known ligand 0.47

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 10/20 0.47
JMJD6 Q6NYC1 1/20 0.39
GRIN1 Q05586 3/20 0.38
GRIN2B Q13224 3/20 0.38
ALDH1A1 P00352 4/20 0.38
GRM2 Q14416 1/20 0.36
KDM4E B2RXH2 1/20 0.36

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
SCHEMBL5838570 0.88 MAPK14 (0.50) MAPK14JMJD6GRIN1GRIN2B
SCHEMBL5838695 0.87 MAPK14 (0.52) MAPK14JMJD6GRIN1GRIN2BALDH1A1
SCHEMBL5837021 0.83 MAPK14 (0.48) MAPK14GRIN1GRIN2BALDH1A1GRM2
SCHEMBL5836111 0.81 MAPK14 (0.43) MAPK14GRIN1GRIN2BALDH1A1KDM4E
SCHEMBL5836981 0.80 GRIN2B (0.50) MAPK14GRIN2BALDH1A1
SCHEMBL5836676 0.79 MAPK14 (0.43) MAPK14GRIN1GRIN2BALDH1A1GRM2
SCHEMBL5837511 0.75 MAPK14 (0.45) MAPK14GRIN2BALDH1A1
SCHEMBL5836827 0.74 MAPK14 (0.55) MAPK14JMJD6GRIN1GRIN2B
SCHEMBL5836447 0.73 MAPK14 (0.54) MAPK14JMJD6
SCHEMBL5836524 0.71 MAPK14 (0.52) MAPK14GRIN1GRIN2B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7056918-B2 Benzimidazole anti-inflammatory compounds PFIZER, INC. (US) 2006-06-06 US disclosed
EP-1370557-B1 BENZIMIDAZOLE ANTI-INFLAMMATORY COMPOUNDS PFIZER PROD INC (US) 2005-11-16 EP disclosed
EP-1370557-A1 BENZIMIDAZOLE ANTI-INFLAMMATORY COMPOUNDS Pfizer Products Inc. (US) 2003-12-17 EP disclosed
US-20030092749-A1 Novel benzimidazole anti-inflammatory compounds PFIZER INC. 2003-05-15 US disclosed
WO-2002072576-A1 BENZIMIDAZOLE ANTI-INFLAMMATORY COMPOUNDS PFIZER PRODUCTS INC. (US) 2002-09-19 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-20030092749-A1 Novel benzimidazole anti-inflammatory compounds MAPK1, JAK1, CNKSR1 MAPK14 22/4885JMJD6 1424/4885GRIN1 560/4885

“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.