SCHEMBL4768232

SCHEMBL4768232

O=C(Nc1ccc2c(c1)CCN(C1CCC1)CC2)c1ccc(-c2cnccn2)cc1

nearest known ligand 0.51

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 5/20 0.50
SMN1; SMN2 Q16637 5/20 0.50
NPC1 O15118 4/20 0.50
TP53 P04637 3/20 0.50
HTT P42858 2/20 0.50
MLLT1 Q03111 1/20 0.50
HRH3 Q9Y5N1 9/20 0.48
NFKB1 P19838 3/20 0.45
NFKB2 Q00653 3/20 0.45
RELA Q04206 3/20 0.45
GAA P10253 1/20 0.45
MELK Q14680 1/20 0.45
CREBBP Q92793 1/20 0.45
MAPT P10636 2/20 0.44
ALDH1A1 P00352 2/20 0.44
LMNA P02545 1/20 0.44
SLC2A1 P11166 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
SCHEMBL4767935 0.92 ABL1 (0.50) RAB9ASMN1; SMN2NPC1TP53HTT
SCHEMBL4765298 0.91 NPC1 (0.55) RAB9ASMN1; SMN2NPC1TP53HTT
SCHEMBL4768282 0.88 CREBBP (0.58) RAB9ASMN1; SMN2NPC1TP53HTT
SCHEMBL4765986 0.87 MLLT1 (0.50) RAB9ASMN1; SMN2NPC1TP53HTT
SCHEMBL4770268 0.86 CREBBP (0.55) RAB9ASMN1; SMN2NPC1TP53HTT
SCHEMBL4771974 0.86 CREBBP (0.58) RAB9ASMN1; SMN2NPC1TP53HTT
SCHEMBL4767467 0.84 HRH3 (0.50) RAB9ASMN1; SMN2NPC1TP53HTT
SCHEMBL4770989 0.84 SMN1; SMN2 (0.71) RAB9ASMN1; SMN2NPC1TP53HTT
SCHEMBL4767429 0.84 RAB9A (0.55) RAB9ASMN1; SMN2NPC1TP53HTT
SCHEMBL4768020 0.84 SLC2A1 (0.53) RAB9ASMN1; SMN2NPC1TP53HTT

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 4 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
US-20070060566-A1 Benzazepine derivatives as histamine h3 antagonists GLAXO GROUP LIMITED (GB) 2007-03-15 US 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 RAB9A 2307/4885SMN1; SMN2 2487/4885NPC1 2009/4885

“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.