SCHEMBL4765840

SCHEMBL4765840

N#Cc1ccc(-c2cnc(C(=O)Nc3ccc4c(c3)CCN(C3CCC3)CC4)cn2)cc1

nearest known ligand 0.48

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 7/20 0.48
HRH1 P35367 1/20 0.48
NPC1 O15118 2/20 0.47
TP53 P04637 2/20 0.47
RAB9A P51151 2/20 0.47
SMN1; SMN2 Q16637 2/20 0.47
MAPT P10636 1/20 0.47
NFKB1 P19838 1/20 0.47
NFKB2 Q00653 1/20 0.47
RELA Q04206 1/20 0.47
PRKAA2 P54646 1/20 0.44
MCHR1 Q99705 5/20 0.43
BACE1 P56817 3/20 0.42
BACE2 Q9Y5Z0 3/20 0.42
HTT P42858 1/20 0.42

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
SCHEMBL4765460 0.91 HRH3 (0.47) HRH3HRH1NPC1TP53RAB9A
SCHEMBL4765557 0.90 HRH3 (0.52) HRH3HRH1NPC1TP53RAB9A
SCHEMBL14580448 0.88 HRH3 (0.50) HRH3HRH1NPC1TP53RAB9A
SCHEMBL4768438 0.88 HRH3 (0.48) HRH3RAB9ASMN1; SMN2MAPTPRKAA2
SCHEMBL4774565 0.83 HRH3 (0.54) HRH3HRH1NPC1TP53RAB9A
SCHEMBL4772566 0.82 RAB9A (0.57) HRH3HRH1NPC1TP53RAB9A
SCHEMBL4767142 0.82 DPP4 (0.53) HRH3NPC1TP53RAB9ASMN1; SMN2
SCHEMBL4771503 0.81 HRH3 (0.56) HRH3HRH1NPC1TP53RAB9A
SCHEMBL4774177 0.81 HRH3 (0.69) HRH3HRH1NPC1TP53RAB9A
SCHEMBL4770900 0.81 HRH3 (0.56) HRH3HRH1NPC1TP53RAB9A

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
EP-1713778-B1 BENZAZEPINE DERIVATIVES AS HISTAMINE H3 ANTAGONISTS GLAXO GROUP LTD (GB) 2008-01-16 EP claimed
US-20070060566-A1 Benzazepine derivatives as histamine h3 antagonists GLAXO GROUP LIMITED (GB) 2007-03-15 US claimed
EP-1713778-B1 BENZAZEPINE DERIVATIVES AS HISTAMINE H3 ANTAGONISTS GLAXO GROUP LTD (GB) 2008-01-16 EP disclosed
EP-1713778-B1 BENZAZEPINE DERIVATIVES AS HISTAMINE H3 ANTAGONISTS GLAXO GROUP LTD (GB) 2008-01-16 EP disclosed
US-20070060566-A1 Benzazepine derivatives as histamine h3 antagonists GLAXO GROUP LIMITED (GB) 2007-03-15 US disclosed
US-20070060566-A1 Benzazepine derivatives as histamine h3 antagonists GLAXO GROUP LIMITED (GB) 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-20070060566-A1 Benzazepine derivatives as histamine h3 antagonists HRH3, HRH4, HRH1 HRH3 1/4885HRH1 3/4885NPC1 2009/4885

“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.