SCHEMBL4765341

SCHEMBL4765341

O=C(Nc1ccc2c(c1)CCN(C1CCC1)CC2)c1ccc(-n2cnnn2)cc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RXFP1 Q9HBX9 1/20 0.53
RAB9A P51151 5/20 0.52
L3MBTL1 Q9Y468 2/20 0.52
HTT P42858 2/20 0.52
KDM4E B2RXH2 2/20 0.52
HRH3 Q9Y5N1 3/20 0.48
CYP3A4 P08684 1/20 0.48
NPC1 O15118 4/20 0.45
SLC2A1 P11166 1/20 0.45
MEN1 O00255 1/20 0.45
KMT2A Q03164 1/20 0.45
SMN1; SMN2 Q16637 4/20 0.45
NFKB1 P19838 3/20 0.45
NFKB2 Q00653 3/20 0.45
RELA Q04206 3/20 0.45
TP53 P04637 2/20 0.45
ALDH1A1 P00352 1/20 0.45
MAPT P10636 1/20 0.45
TSHR P16473 2/20 0.44
L3MBTL3 Q96JM7 1/20 0.44

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
SCHEMBL4768107 0.85 ROCK2 (0.56) RXFP1RAB9AL3MBTL1HTTHRH3
SCHEMBL4769682 0.83 HRH3 (0.54) RAB9AL3MBTL1HTTHRH3NPC1
SCHEMBL4774304 0.83 ROCK2 (0.57) RAB9AL3MBTL1HTTHRH3NPC1
SCHEMBL4765500 0.82 ROCK2 (0.56) RAB9AL3MBTL1HTTHRH3NPC1
SCHEMBL4765905 0.81 NPC1 (0.69) RAB9AL3MBTL1HTTKDM4EHRH3
SCHEMBL4765225 0.81 HRH3 (0.55) RAB9AL3MBTL1HTTHRH3NPC1
SCHEMBL4768058 0.81 NPC1 (0.69) RAB9AL3MBTL1HTTHRH3NPC1
SCHEMBL4768020 0.81 SLC2A1 (0.53) RAB9AL3MBTL1HTTKDM4EHRH3
SCHEMBL4767978 0.81 ATM (0.56) RAB9AKDM4EHRH3NPC1MEN1
SCHEMBL4770268 0.80 CREBBP (0.55) RAB9AL3MBTL1HTTHRH3NPC1

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 3 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

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 RXFP1 3077/4885RAB9A 2307/4885L3MBTL1 1581/4885

“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.