SCHEMBL4765684

SCHEMBL4765684

O=C(Nc1ccc2c(c1)CCN(C1CCC1)CC2)N1CCC(c2ccncc2)CC1

nearest known ligand 0.47

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
NAMPT P43490 12/20 0.47
CYP3A4 P08684 1/20 0.47
CYP2D6 P10635 1/20 0.47
CYP2C19 P33261 1/20 0.47
HRH3 Q9Y5N1 1/20 0.45
NPC1 O15118 2/20 0.44
GPR142 Q7Z601 2/20 0.43
TP53 P04637 3/20 0.43
MAPT P10636 3/20 0.43
NFKB1 P19838 1/20 0.43
HTT P42858 1/20 0.43
RAB9A P51151 1/20 0.43
NFKB2 Q00653 1/20 0.43
RELA Q04206 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
LMNA P02545 1/20 0.43

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 0.90 NPC1 (0.56) NAMPTCYP3A4CYP2D6CYP2C19HRH3
SCHEMBL4765645 0.88 NPC1 (0.53) NAMPTCYP3A4CYP2D6CYP2C19HRH3
SCHEMBL4772427 0.85 CCR2 (0.46) NAMPTCYP3A4CYP2D6CYP2C19HRH3
SCHEMBL4771050 0.85 CYP3A4 (0.56) NAMPTCYP3A4CYP2D6CYP2C19HRH3
SCHEMBL4767666 0.84 CYP3A4 (0.58) NAMPTCYP3A4CYP2D6CYP2C19HRH3
SCHEMBL4771923 0.83 HRH3 (0.48) NAMPTCYP3A4CYP2D6CYP2C19HRH3
SCHEMBL4767933 0.82 RAB9A (0.52) NAMPTCYP3A4CYP2D6CYP2C19HRH3
SCHEMBL14440719 0.82 NAMPT (0.44) NAMPTCYP3A4CYP2D6CYP2C19HRH3
SCHEMBL4774290 0.82 HRH3 (0.50) HRH3NPC1RAB9ALMNA
SCHEMBL5464234 0.81 SMN1; SMN2 (0.51) NAMPTCYP2C19HRH3NPC1MAPT

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 NAMPT 2325/4885CYP3A4 1447/4885CYP2D6 1672/4885

“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.