SCHEMBL4456616

SCHEMBL4456616

CCN(CC)C(=O)c1ccc2c(c1)nc(C(C)(C)C)n2C[C@H]1CCCCN1C

nearest known ligand 0.65

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 18/20 0.65
CNR1 P21554 4/20 0.65
BCHE P06276 5/20 0.46
OPRM1 P35372 1/20 0.46
ACHE P22303 2/20 0.44

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
SCHEMBL13889151 1.00 CNR2 (0.65) CNR2CNR1BCHEOPRM1ACHE
SCHEMBL4469062 0.85 CNR2 (0.62) CNR2CNR1
SCHEMBL5434905 0.80 CNR2 (0.46) CNR2CNR1
SCHEMBL5432919 0.80 CNR2 (0.46) CNR2CNR1
SCHEMBL4967003 0.79 CNR2 (0.47) CNR2CNR1
SCHEMBL4968535 0.79 CNR2 (0.47) CNR2CNR1
SCHEMBL5884200 0.79 CNR2 (1.00) CNR2CNR1BCHEOPRM1ACHE
SCHEMBL5882005 0.79 CNR2 (1.00) CNR2CNR1BCHEOPRM1ACHE
SCHEMBL5881694 0.79 CNR2 (1.00) CNR2CNR1BCHEOPRM1ACHE
SCHEMBL14116499 0.78 ALDH1A1 (0.46) CNR2CNR1

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-20070060583-A1 Benzimidazole derivatives, compositions containing them, preparation therof and uses thereof ASTRAZENECA AB (SE) 2007-03-15 US claimed
JP-2006527247-A 2006-11-30 JP claimed
EP-1636193-A1 BENZIMIDAZOLE DERIVATIVES, COMPOSITIONS CONTAINING THEM, PREPARATION THEREOF AND USES THEREOF AstraZeneca AB (SE) 2006-03-22 EP claimed
WO-2004108688-A1 BENZIMIDAZOLE DERIVATIVES, COMPOSITIONS CONTAINING THEM, PREPARATION THEREOF AND USES THEREOF ASTRAZENECA AB (SE) 2004-12-16 WO claimed
US-7517898-B2 Benzimidazole derivatives, compositions containing them, preparation thereof and uses thereof ASTRAZENECA AB (SE) 2009-04-14 US disclosed
US-20070060583-A1 Benzimidazole derivatives, compositions containing them, preparation therof and uses thereof ASTRAZENECA AB (SE) 2007-03-15 US 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-20070060583-A1 Benzimidazole derivatives, compositions containing them, preparation therof and uses thereof BTF3, TYMS, F3 CNR2 1312/4885CNR1 1207/4885BCHE 1728/4885

“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.