SCHEMBL738416

SCHEMBL738416

O=c1[nH]c2cccc(Cl)c2n1CCN1CCOCC1

nearest known ligand 0.47

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HTR7 P34969 2/20 0.47
CYP2A13 Q16696 3/20 0.46
ADRA1B P35368 1/20 0.45
OPRM1 P35372 1/20 0.45
CTDSP1 Q9GZU7 1/20 0.43
ALDH1A1 P00352 2/20 0.42
HPGD P15428 2/20 0.42
KDM4E B2RXH2 1/20 0.42
MEN1 O00255 1/20 0.42
CYP2C9 P11712 1/20 0.42
KMT2A Q03164 1/20 0.42
ATM Q13315 1/20 0.42
P2RX7 Q99572 1/20 0.42
HTR1A P08908 1/20 0.41

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
SCHEMBL737401 0.84 DAO (0.48) HTR7CYP2A13CTDSP1ALDH1A1MEN1
SCHEMBL739228 0.78 HTR7 (0.73) HTR7OPRM1ALDH1A1HPGDMEN1
Hydrochloric Acid SCHEMBL9725420 0.77 HTR7 (0.71) HTR7OPRM1ALDH1A1HPGDMEN1
SCHEMBL11199441 0.76 PSMB8 (0.43) HTR7ADRA1BOPRM1ALDH1A1HPGD
SCHEMBL11193325 0.75 ALDH1A1 (0.57) HTR7ADRA1BOPRM1ALDH1A1HPGD
SCHEMBL737292 0.75 DAO (0.49) HTR7CTDSP1ALDH1A1KDM4ECYP2C9
SCHEMBL7265868 0.74 HTR7 (0.47) HTR7CTDSP1ALDH1A1HPGDKDM4E
SCHEMBL738090 0.74 HTR7 (0.50) HTR7OPRM1KDM4EMEN1KMT2A
SCHEMBL11196807 0.73 P2RX7 (0.71) HTR7ADRA1BOPRM1MEN1CYP2C9
Hydrochloric Acid SCHEMBL9725415 0.73 HTR7 (0.49) HTR7OPRM1KDM4EMEN1KMT2A

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 8 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
EP-1861377-B1 BENZIMIDAZOLONE DERIVATIVES AS CB2 RECEPTOR LIGANDS PFIZER (US) 2010-12-29 EP disclosed
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
US-20090181957-A1 BENZIMIDAZOLONE DERIVATIVES AS CB2 RECEPTOR LIGANDS ANDO KAZUO 2009-07-16 US disclosed
WO-2008032164-A2 BENZIMIDAZOLONE DERIVATIVES PFIZER PRODUCTS INC. (US) 2008-03-20 WO disclosed
EP-1861377-A1 BENZIMIDAZOLONE DERIVATIVES AS CB2 RECEPTOR LIGANDS Pfizer, Inc. (US) 2007-12-05 EP disclosed
WO-2006097808-A1 BENZIMIDAZOLONE DERIVATIVES AS CB2 RECEPTOR LIGANDS PFIZER JAPAN INC. (JP) 2006-09-21 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 (2 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 HTR7 209/4885CYP2A13 1986/4885ADRA1B 62/4885
US-20090181957-A1 BENZIMIDAZOLONE DERIVATIVES AS CB2 RECEPTOR LIGANDS TRPV1, CNR1, CNR2 HTR7 335/4885CYP2A13 1320/4885ADRA1B 87/4885

“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.