SCHEMBL5838570

SCHEMBL5838570

CCn1c(=O)n(CC)c2cc(-c3cn(CC(=O)OC(C)(C)C)nc3-c3cccc(C)c3)ccc21

nearest known ligand 0.50

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 13/20 0.50
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
JMJD6 Q6NYC1 1/20 0.38
ENPP2 Q13822 1/20 0.36
GRIN1 Q05586 2/20 0.35
GRIN2B Q13224 2/20 0.35
TGFBR1 P36897 1/20 0.34

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
SCHEMBL5837591 0.88 MAPK14 (0.47) MAPK14JMJD6GRIN1GRIN2B
SCHEMBL5836827 0.87 MAPK14 (0.55) MAPK14MEN1KMT2AJMJD6GRIN1
SCHEMBL5837511 0.87 MAPK14 (0.45) MAPK14MEN1KMT2AGRIN2B
SCHEMBL5836447 0.86 MAPK14 (0.54) MAPK14MEN1KMT2AJMJD6
SCHEMBL5836524 0.84 MAPK14 (0.52) MAPK14GRIN1GRIN2BTGFBR1
SCHEMBL5836901 0.82 MAPK14 (0.56) MAPK14MEN1KMT2AJMJD6TGFBR1
SCHEMBL5836517 0.82 MAPK14 (0.49) MAPK14MEN1KMT2AGRIN1GRIN2B
SCHEMBL5837967 0.81 MAPK14 (0.53) MAPK14MEN1KMT2AGRIN1GRIN2B
SCHEMBL5838717 0.81 MAPK14 (0.47) MAPK14GRIN1GRIN2B
SCHEMBL5838005 0.81 MAPK14 (0.49) 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 22/4885MEN1 4415/4885KMT2A 4432/4885

“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.