SCHEMBL3915097

SCHEMBL3915097

CCCCCn1c(=O)n(C(=O)N[C@H]2CCCc3ccccc32)c2ccccc21

nearest known ligand 0.70

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 8/20 0.70
CNR1 P21554 5/20 0.70
L3MBTL1 Q9Y468 1/20 0.54
HTT P42858 2/20 0.51
TAOK1 Q7L7X3 3/20 0.48
TAOK3 Q9H2K8 3/20 0.48
ALDH1A1 P00352 2/20 0.48
MAPT P10636 1/20 0.47
TMEM97 Q5BJF2 1/20 0.47
SIGMAR1 Q99720 1/20 0.47
HTR3A P46098 1/20 0.47
HTR4 Q13639 1/20 0.47

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
SCHEMBL760922 0.86 CNR2 (0.70) CNR2CNR1HTTALDH1A1MAPT
SCHEMBL762507 0.85 CNR2 (0.87) CNR2CNR1HTTALDH1A1MAPT
Hydrochloric Acid SCHEMBL3394158 0.84 CNR2 (0.86) CNR2CNR1HTTALDH1A1MAPT
SCHEMBL4394942 0.83 CNR2 (0.68) CNR2CNR1HTTALDH1A1MAPT
SCHEMBL737219 0.83 CNR2 (1.00) CNR2CNR1TAOK3
SCHEMBL4120174 0.83 CNR2 (1.00) CNR2CNR1TAOK3
SCHEMBL4387120 0.82 CNR2 (0.67) CNR2CNR1HTTTAOK1TAOK3
Hydrochloric Acid SCHEMBL3393278 0.82 CNR2 (0.98) CNR2CNR1TAOK3
Hydrochloric Acid SCHEMBL3390668 0.82 CNR2 (0.98) CNR2CNR1TAOK3
SCHEMBL3916155 0.80 CNR2 (0.58) CNR2CNR1TMEM97SIGMAR1HTR3A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090298811-A1 BENZIMIDAZOLONE DERIVATIVES PFIZER INC 2009-12-03 US claimed
EP-2114897-A2 BENZIMIDAZOLONE DERIVATIVES Pfizer Products Inc. (US) 2009-11-11 EP claimed
WO-2008032164-A2 BENZIMIDAZOLONE DERIVATIVES PFIZER PRODUCTS INC. (US) 2008-03-20 WO claimed
US-20090298811-A1 BENZIMIDAZOLONE DERIVATIVES PFIZER INC 2009-12-03 US disclosed
EP-2114897-A2 BENZIMIDAZOLONE DERIVATIVES Pfizer Products Inc. (US) 2009-11-11 EP disclosed
WO-2008032164-A2 BENZIMIDAZOLONE DERIVATIVES PFIZER PRODUCTS INC. (US) 2008-03-20 WO disclosed
WO-2008032164-A2 BENZIMIDAZOLONE DERIVATIVES PFIZER PRODUCTS INC. (US) 2008-03-20 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-20090298811-A1 BENZIMIDAZOLONE DERIVATIVES TRPV1, CNR1, CNR2 CNR2 3/4885CNR1 2/4885L3MBTL1 3497/4885

“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.