SCHEMBL6071407

SCHEMBL6071407

O=C1NCCCc2cc(OCCCN3CCCCC3)ccc21

nearest known ligand 0.71

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 13/20 0.71
HRH1 P35367 1/20 0.60
MAOA P21397 1/20 0.56
MAOB P27338 1/20 0.56
DRD2 P14416 1/20 0.53

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
SCHEMBL5100387 0.94 HRH3 (0.72) HRH3HRH1MAOAMAOBDRD2
SCHEMBL5101073 0.85 HRH3 (0.72) HRH3HRH1MAOAMAOBDRD2
SCHEMBL14287615 0.84 HRH3 (0.88) HRH3HRH1MAOAMAOB
SCHEMBL5106942 0.83 HRH3 (0.70) HRH3HRH1MAOAMAOBDRD2
SCHEMBL6583935 0.83 MAOB (0.47) HRH3MAOAMAOBDRD2
SCHEMBL6329923 0.83 HRH3 (1.00) HRH3HRH1MAOAMAOB
Hydrochloric Acid SCHEMBL6110535 0.82 HRH3 (0.97) HRH3HRH1MAOAMAOB
SCHEMBL8309880 0.81 HRH3 (0.50) HRH3DRD2
SCHEMBL6585091 0.80 HRH3 (0.49) HRH3HRH1DRD2
SCHEMBL6149725 0.80 HRH3 (0.93) HRH3HRH1MAOAMAOB

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20060089347-A1 Substituted azepines as histamine h3 receptor antagonists, preparation and therapeutic uses ELI LILLY AND COMPANY (US) 2006-04-27 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-20060089347-A1 Substituted azepines as histamine h3 receptor antagonists, preparation and therapeutic uses HRH3, HRH4, HRH2 HRH3 1/4885HRH1 4/4885MAOA 700/4885

“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.