SCHEMBL5837161

SCHEMBL5837161

CCn1c(=O)n(CC)c2cc(-c3cn(CC(=O)O)nc3-c3ccccc3)ccc21

nearest known ligand 0.53

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 11/20 0.53
PTGIR P43119 1/20 0.45
APEX1 P27695 1/20 0.41
HSD17B10 Q99714 1/20 0.40
TGFBR1 P36897 1/20 0.38
KDM4E B2RXH2 1/20 0.38
ALDH1A1 P00352 1/20 0.38
GAA P10253 1/20 0.38
MAPT P10636 1/20 0.38
GFER P55789 1/20 0.38

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
SCHEMBL5836827 0.91 MAPK14 (0.55) MAPK14TGFBR1
SCHEMBL5837901 0.85 MAPK14 (0.47) MAPK14PTGIRHSD17B10KDM4E
SCHEMBL5837713 0.84 MAPK14 (0.44) MAPK14TGFBR1KDM4EMAPTGFER
SCHEMBL5837596 0.84 MAPK14 (0.52) MAPK14PTGIRKDM4EALDH1A1GAA
SCHEMBL5836447 0.82 MAPK14 (0.54) MAPK14
SCHEMBL5837125 0.81 MAPK14 (0.45) MAPK14HSD17B10TGFBR1ALDH1A1
SCHEMBL5837214 0.80 MAPK14 (0.48) MAPK14HSD17B10ALDH1A1
SCHEMBL5836524 0.80 MAPK14 (0.52) MAPK14TGFBR1
SCHEMBL5836901 0.79 MAPK14 (0.56) MAPK14PTGIRTGFBR1ALDH1A1
SCHEMBL5838570 0.78 MAPK14 (0.50) MAPK14TGFBR1

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 22/4885PTGIR 371/4885APEX1 3638/4885

“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.