SCHEMBL736776

SCHEMBL736776

CC(C)(C)Cn1c(=O)n(C(=O)NCC(C)(C)CC(N)=O)c2ccccc21

nearest known ligand 0.51

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 11/20 0.51
CNR1 P21554 5/20 0.44
NPC1 O15118 1/20 0.39
GAA P10253 1/20 0.39
ASAH1 Q13510 1/20 0.38
GRM2 Q14416 1/20 0.37

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
SCHEMBL738286 0.92 CNR2 (0.61) CNR2CNR1NPC1GAAASAH1
SCHEMBL4385751 0.89 CNR2 (0.53) CNR2CNR1
SCHEMBL739854 0.84 CNR2 (0.64) CNR2CNR1
SCHEMBL735903 0.84 CNR2 (0.48) CNR2CNR1
SCHEMBL4377379 0.83 L3MBTL1 (0.50) CNR2CNR1NPC1
SCHEMBL740116 0.75 CNR2 (0.85) CNR2CNR1
SCHEMBL4379407 0.75 CNR2 (0.49) CNR2CNR1
SCHEMBL739956 0.72 CNR2 (0.49) CNR2CNR1GAA
SCHEMBL737086 0.71 CNR2 (0.47) CNR2CNR1
Hydrochloric Acid SCHEMBL736667 0.70 CNR2 (0.50) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8138177-B2 Benzimidazolone derivatives as CB2 receptor ligands PFIZER INC. (US) 2012-03-20 US disclosed
US-20090181957-A1 BENZIMIDAZOLONE DERIVATIVES AS CB2 RECEPTOR LIGANDS ANDO KAZUO 2009-07-16 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-20090181957-A1 BENZIMIDAZOLONE DERIVATIVES AS CB2 RECEPTOR LIGANDS TRPV1, CNR1, CNR2 CNR2 3/4885CNR1 2/4885NPC1 964/4885

“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.