SCHEMBL4765394

SCHEMBL4765394

O=C(Nc1ccc2c(c1)CCN(C1CCC1)CC2)N1CCC(Oc2ccccn2)CC1

nearest known ligand 0.55

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 8/20 0.55
NAMPT P43490 11/20 0.50
EPHX2 P34913 1/20 0.48
CYP2D6 P10635 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
SCHEMBL4764947 0.86 HRH3 (0.56) HRH3NAMPTCYP2D6
SCHEMBL4771923 0.84 HRH3 (0.48) HRH3NAMPTEPHX2CYP2D6
SCHEMBL4765338 0.83 HRH3 (0.56) HRH3NAMPTEPHX2CYP2D6
SCHEMBL4767933 0.82 RAB9A (0.52) HRH3NAMPTCYP2D6
SCHEMBL4768450 0.80 HRH3 (0.57) HRH3CYP2D6
SCHEMBL4774355 0.80 HRH3 (0.57) HRH3NAMPTCYP2D6
SCHEMBL4771050 0.80 CYP3A4 (0.56) HRH3NAMPTCYP2D6
SCHEMBL4767666 0.79 CYP3A4 (0.58) HRH3NAMPTCYP2D6
SCHEMBL4767921 0.79 NPC1 (0.56) HRH3NAMPTCYP2D6
SCHEMBL5823896 0.78 HRH3 (0.54) HRH3

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 1/4885NAMPT 2325/4885EPHX2 447/4885

“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.