SCHEMBL4765111

SCHEMBL4765111

O=C(Nc1ccc2c(c1)CCN(C1CCC1)CC2)c1ccc2[nH]nnc2c1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 7/20 0.46
L3MBTL3 Q96JM7 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
RAB9A P51151 4/20 0.42
SMN1; SMN2 Q16637 4/20 0.42
NPC1 O15118 3/20 0.42
NFKB1 P19838 3/20 0.42
NFKB2 Q00653 3/20 0.42
RELA Q04206 3/20 0.42
TP53 P04637 2/20 0.42
ALDH1A1 P00352 2/20 0.42
MAPT P10636 2/20 0.42
TMPRSS2 O15393 3/20 0.41
MELK Q14680 1/20 0.41
CD40 P25942 1/20 0.41
CD40LG P29965 1/20 0.41
GAA P10253 1/20 0.41
HTT P42858 1/20 0.41
KDM2B Q8NHM5 1/20 0.41
LMNA P02545 1/20 0.41

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
SCHEMBL4770147 0.83 HRH3 (0.46) HRH3L3MBTL3L3MBTL1RAB9ASMN1; SMN2
SCHEMBL6293576 0.83 ROCK2 (0.52)
SCHEMBL4770201 0.82 SMN1; SMN2 (0.50) HRH3RAB9ASMN1; SMN2NPC1NFKB1
SCHEMBL4772409 0.81 RAB9A (0.51) HRH3L3MBTL3L3MBTL1RAB9ASMN1; SMN2
SCHEMBL4775503 0.81 MAPT (0.54) RAB9ASMN1; SMN2NPC1TP53MAPT
SCHEMBL4768412 0.80 MAOA (0.53) HRH3RAB9ANPC1MAPTTMPRSS2
SCHEMBL4774510 0.80 RAB9A (0.57) HRH3RAB9ASMN1; SMN2NPC1TP53
SCHEMBL4768483 0.79 ALDH1A1 (0.51) HRH3L3MBTL3L3MBTL1RAB9ASMN1; SMN2
SCHEMBL4768058 0.78 NPC1 (0.69) HRH3L3MBTL3L3MBTL1RAB9ASMN1; SMN2
SCHEMBL4765225 0.78 HRH3 (0.55) HRH3L3MBTL3L3MBTL1RAB9ASMN1; SMN2

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 1/4885L3MBTL3 1688/4885L3MBTL1 1581/4885

“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.