SCHEMBL4498063

SCHEMBL4498063

O=C(NCCN1CCCCC1)c1ccc(OCCCN2CC3CCCC3C2)cc1

nearest known ligand 0.64

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 10/20 0.64
GLA P06280 1/20 0.60
L3MBTL1 Q9Y468 1/20 0.60
MAOB P27338 1/20 0.58
POLB P06746 1/20 0.57
CYP1A2 P05177 1/20 0.54
CYP2D6 P10635 1/20 0.54
CYP2C9 P11712 1/20 0.54
SLC2A1 P11166 1/20 0.54
KDM4E B2RXH2 2/20 0.53
ALDH1A1 P00352 2/20 0.52
NPSR1 Q6W5P4 1/20 0.51

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
SCHEMBL4493597 0.91 HRH3 (0.60) HRH3GLAL3MBTL1MAOBALDH1A1
SCHEMBL5106634 0.90 GLA (0.73) HRH3GLAL3MBTL1MAOBPOLB
SCHEMBL4622140 0.87 HRH3 (0.66) HRH3GLAL3MBTL1POLB
SCHEMBL4622753 0.87 HRH3 (0.66) HRH3GLAL3MBTL1MAOBPOLB
SCHEMBL4486761 0.86 HRH3 (0.65) HRH3POLBSLC2A1KDM4EALDH1A1
SCHEMBL14287848 0.85 HRH3 (0.66) HRH3GLAL3MBTL1MAOBPOLB
SCHEMBL4495437 0.84 HRH3 (0.69) HRH3GLAL3MBTL1MAOB
Oxalic Acid SCHEMBL4506368 0.84 HRH3 (0.62) HRH3GLAL3MBTL1POLBKDM4E
Oxalic Acid SCHEMBL4489113 0.84 HRH3 (0.62) HRH3GLAL3MBTL1POLBKDM4E
SCHEMBL11757419 0.84 HRH3 (0.64) HRH3GLAL3MBTL1MAOBPOLB

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
US-7576120-B2 Azabicyclic compounds, a process for their preparation and pharmaceutical compositions containing them LES LABORATOIRES SERVIER (FR) 2009-08-18 US disclosed
EP-1720544-B1 NOVEL AZABICYCLIC DERIVATIVES, PREPARATION METHOD THEREOF AND PHARMACEUTICAL COMPOSITIONS CONTAINING SAME SERVIER LAB (FR) 2008-03-19 EP disclosed
US-20070197625-A1 Azabicyclic compounds, a process for their preparation and pharmaceutical compositions containing them. LES LABORATORATIES SERVIER (FR) 2007-08-23 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-20070197625-A1 Azabicyclic compounds, a process for their preparation and pharmaceutical compositions containing them. HRH2, HNMT, HRH1 HRH3 9/4885GLA 3973/4885L3MBTL1 4790/4885

“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.