SCHEMBL4765359

SCHEMBL4765359

O=C(Nc1ccc2c(c1)CCN(C1CCC1)CC2)c1cnn(-c2ccccc2)c1-c1ccccc1

nearest known ligand 0.45

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 9/20 0.44
RAB9A P51151 9/20 0.44
MEN1 O00255 5/20 0.44
KMT2A Q03164 5/20 0.44
PKM P14618 1/20 0.44
HRH3 Q9Y5N1 3/20 0.43
ATM Q13315 1/20 0.41
TP53 P04637 2/20 0.41
NFKB1 P19838 2/20 0.41
HTT P42858 2/20 0.41
NFKB2 Q00653 2/20 0.41
RELA Q04206 2/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
GAA P10253 1/20 0.41
MAPT P10636 1/20 0.41
ALDH1A1 P00352 1/20 0.41
PSMD14 O00487 1/20 0.40
THRB P10828 1/20 0.40
RXFP1 Q9HBX9 1/20 0.40

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
Hydrochloric Acid SCHEMBL4772031 0.99 NPC1 (0.43) NPC1RAB9AMEN1KMT2APKM
SCHEMBL4774462 0.88 RAB9A (0.59) NPC1RAB9AMEN1KMT2APKM
SCHEMBL4765960 0.86 NR1H4 (0.52) NPC1RAB9APKMHRH3SMN1; SMN2
SCHEMBL4765267 0.86 MEN1 (0.58) MEN1KMT2ATP53SMN1; SMN2GAA
Hydrochloric Acid SCHEMBL4770084 0.85 NR1H4 (0.51) NPC1RAB9APKMSMN1; SMN2MAPT
Hydrochloric Acid SCHEMBL4767939 0.85 MEN1 (0.57) MEN1KMT2ATP53SMN1; SMN2GAA
SCHEMBL4765178 0.84 ALDH1A1 (0.58) KMT2AHRH3HTTGAAMAPT
Hydrochloric Acid SCHEMBL4765416 0.84 ALDH1A1 (0.57) KMT2AHTTGAAMAPTALDH1A1
SCHEMBL4765564 0.81 HRH3 (0.46) NPC1RAB9AMEN1KMT2AHRH3
Trifluoroacetic Acid SCHEMBL4771045 0.81 RAB9A (0.53) NPC1RAB9AMEN1KMT2APKM

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 2 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

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 NPC1 2009/4885RAB9A 2307/4885MEN1 2213/4885

“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.