SCHEMBL4771923

SCHEMBL4771923

O=C(Nc1ccc2c(c1)CCN(C1CCC1)CC2)N1CCC(c2ccccn2)CC1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 3/20 0.48
PRMT5 O14744 1/20 0.45
WDR77 Q9BQA1 1/20 0.45
CYP3A4 P08684 1/20 0.44
CYP2D6 P10635 1/20 0.44
CYP2C19 P33261 1/20 0.44
LMNA P02545 2/20 0.44
KDM4E B2RXH2 1/20 0.44
ALDH1A1 P00352 1/20 0.44
HSD17B10 Q99714 1/20 0.44
DRD2 P14416 3/20 0.43
DRD4 P21917 3/20 0.43
DRD3 P35462 3/20 0.43
NPC1 O15118 3/20 0.43
RAB9A P51151 3/20 0.43
EPHX2 P34913 1/20 0.43
KCNH2 Q12809 1/20 0.43
CACNA1C Q13936 1/20 0.43
NAMPT P43490 2/20 0.42
SMN1; SMN2 Q16637 2/20 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
SCHEMBL4767921 0.85 NPC1 (0.56) HRH3CYP3A4CYP2D6CYP2C19LMNA
SCHEMBL4767933 0.84 RAB9A (0.52) HRH3CYP3A4CYP2D6CYP2C19ALDH1A1
SCHEMBL4765394 0.84 HRH3 (0.55) HRH3CYP2D6EPHX2NAMPT
SCHEMBL4765684 0.83 NAMPT (0.47) HRH3CYP3A4CYP2D6CYP2C19LMNA
SCHEMBL4771050 0.82 CYP3A4 (0.56) HRH3CYP3A4CYP2D6CYP2C19NPC1
SCHEMBL4767666 0.81 CYP3A4 (0.58) HRH3CYP3A4CYP2D6CYP2C19KDM4E
SCHEMBL5823896 0.81 HRH3 (0.54) HRH3LMNAKDM4EALDH1A1HSD17B10
SCHEMBL4768332 0.80 NAMPT (0.61) HRH3ALDH1A1NPC1RAB9AKCNH2
SCHEMBL4765114 0.79 RAB9A (0.61) ALDH1A1NPC1RAB9ANAMPTSMN1; SMN2
SCHEMBL4765645 0.79 NPC1 (0.53) HRH3CYP3A4CYP2D6CYP2C19NPC1

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 HRH3 1/4885PRMT5 929/4885WDR77 1003/4885

“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.