SCHEMBL1169846

SCHEMBL1169846

Cc1noc(-c2ccc(C(=O)N3CCCN(C4CCC4)CC3)cc2)n1

nearest known ligand 0.53

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
L3MBTL3 Q96JM7 10/20 0.53
L3MBTL1 Q9Y468 8/20 0.53
HRH3 Q9Y5N1 6/20 0.49
MBTD1 Q05BQ5 4/20 0.48
TP53BP1 Q12888 1/20 0.48
L3MBTL4 Q8NA19 1/20 0.48
KDM4E B2RXH2 1/20 0.46
GPR119 Q8TDV5 1/20 0.46

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
Hydrochloric Acid SCHEMBL1169593 0.99 L3MBTL3 (0.52) L3MBTL3L3MBTL1HRH3MBTD1TP53BP1
SCHEMBL600062 0.91 L3MBTL3 (0.44) L3MBTL3L3MBTL1HRH3MBTD1KDM4E
SCHEMBL1170059 0.84 L3MBTL3 (0.54) L3MBTL3L3MBTL1HRH3MBTD1TP53BP1
SCHEMBL1169333 0.82 L3MBTL3 (0.54) L3MBTL3L3MBTL1HRH3MBTD1TP53BP1
SCHEMBL4668242 0.81 HRH3 (0.41) HRH3GPR119
SCHEMBL4666773 0.81 HRH3 (0.41) HRH3GPR119
SCHEMBL4666695 0.81 HRH3 (0.41) HRH3GPR119
SCHEMBL1169899 0.81 CHRNA7 (0.55) HRH3GPR119
Hydrochloric Acid SCHEMBL4666655 0.80 HRH3 (0.40) HRH3GPR119
Hydrochloric Acid SCHEMBL4668308 0.80 HRH3 (0.40) HRH3GPR119

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8492375-B2 1-benzoyl substituted diazepine derivatives as selective histamine H3 receptor agonists GLAXO GROUP LIMITED (GB) 2013-07-23 US claimed
US-20110039833-A1 1-BENZOYL SUBSTITUTED DIAZEPINE DERIVATIVES AS SELECTIVE HISTAMINE H3 RECEPTOR AGONISTS GLAXO GROUP LIMITED (GB) 2011-02-17 US claimed
US-20080045505-A1 1-Benzoyl Substituted Diazepine Derivatives As Selective Histamine H3 Receptor Agonists GLAXO GROUP LIMITED (GB) 2008-02-21 US claimed
US-8492375-B2 1-benzoyl substituted diazepine derivatives as selective histamine H3 receptor agonists GLAXO GROUP LIMITED (GB) 2013-07-23 US disclosed
US-8492375-B2 1-benzoyl substituted diazepine derivatives as selective histamine H3 receptor agonists GLAXO GROUP LIMITED (GB) 2013-07-23 US disclosed
US-20110039833-A1 1-BENZOYL SUBSTITUTED DIAZEPINE DERIVATIVES AS SELECTIVE HISTAMINE H3 RECEPTOR AGONISTS GLAXO GROUP LIMITED (GB) 2011-02-17 US disclosed
US-20110039833-A1 1-BENZOYL SUBSTITUTED DIAZEPINE DERIVATIVES AS SELECTIVE HISTAMINE H3 RECEPTOR AGONISTS GLAXO GROUP LIMITED (GB) 2011-02-17 US disclosed
US-7846922-B2 1-benzoyl substituted diazepine derivatives as selective histamine H3 receptor agonists GLAXO GROUP LIMITED (GB) 2010-12-07 US disclosed
US-7846922-B2 1-benzoyl substituted diazepine derivatives as selective histamine H3 receptor agonists GLAXO GROUP LIMITED (GB) 2010-12-07 US disclosed
US-20080045505-A1 1-Benzoyl Substituted Diazepine Derivatives As Selective Histamine H3 Receptor Agonists GLAXO GROUP LIMITED (GB) 2008-02-21 US disclosed
US-20080045505-A1 1-Benzoyl Substituted Diazepine Derivatives As Selective Histamine H3 Receptor Agonists GLAXO GROUP LIMITED (GB) 2008-02-21 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 (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-20110039833-A1 1-BENZOYL SUBSTITUTED DIAZEPINE DERIVATIVES AS SELECTIVE HISTAMINE H3 RECEPTOR AGONISTS HRH3, HRH4, HRH1 L3MBTL3 3902/4885L3MBTL1 3558/4885HRH3 1/4885
US-20080045505-A1 1-Benzoyl Substituted Diazepine Derivatives As Selective Histamine H3 Receptor Agonists HRH3, HRH4, HRH1 L3MBTL3 4686/4885L3MBTL1 4312/4885HRH3 1/4885

“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.