SCHEMBL4772525

SCHEMBL4772525

Cc1ccc(-n2nc(C)c(C(=O)Nc3ccc4c(c3)CCN(C3CCC3)CC4)n2)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.46
RAB9A P51151 4/20 0.46
ALDH1A1 P00352 3/20 0.46
MAPT P10636 3/20 0.46
NPC1 O15118 3/20 0.46
SMN1; SMN2 Q16637 3/20 0.46
NFKB1 P19838 1/20 0.46
NFKB2 Q00653 1/20 0.46
RELA Q04206 1/20 0.46
HRH3 Q9Y5N1 9/20 0.44
KDM4E B2RXH2 2/20 0.43
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
HPGD P15428 1/20 0.41
CASP3 P42574 1/20 0.41
SENP7 Q9BQF6 1/20 0.41
TMPRSS2 O15393 1/20 0.41
HRH1 P35367 1/20 0.41
L3MBTL3 Q96JM7 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39

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 SCHEMBL4774047 0.99 POLB (0.46) POLBRAB9AALDH1A1MAPTNPC1
SCHEMBL4768161 0.93 POLB (0.56) POLBRAB9AALDH1A1MAPTNPC1
SCHEMBL4770820 0.91 POLB (0.56) POLBRAB9AALDH1A1MAPTNPC1
SCHEMBL4768152 0.90 POLB (0.55) POLBRAB9AALDH1A1MAPTNPC1
Hydrochloric Acid SCHEMBL4768205 0.89 POLB (0.54) POLBRAB9AALDH1A1MAPTNPC1
Trifluoroacetic Acid SCHEMBL4765180 0.87 POLB (0.52) POLBRAB9AALDH1A1MAPTNPC1
SCHEMBL4770197 0.83 POLB (0.53) POLBRAB9AALDH1A1MAPTNPC1
SCHEMBL4770727 0.83 POLB (0.53) POLBRAB9AALDH1A1MAPTNPC1
Hydrochloric Acid SCHEMBL4770711 0.82 POLB (0.52) POLBRAB9AALDH1A1MAPTNPC1
SCHEMBL4765905 0.82 NPC1 (0.69) POLBRAB9AALDH1A1MAPTNPC1

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 POLB 4330/4885RAB9A 2307/4885ALDH1A1 1725/4885

“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.