SCHEMBL4484066

SCHEMBL4484066

O=C(NCCCn1ccnc1)c1ccc(O)cc1

nearest known ligand 0.80

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 5/20 0.80
NPC1 O15118 1/20 0.80
POLB P06746 1/20 0.77
ALDH1A1 P00352 2/20 0.72
MAPT P10636 1/20 0.72
TSHR P16473 1/20 0.72
HTT P42858 2/20 0.70
KDM4E B2RXH2 1/20 0.70
CYP19A1 P11511 1/20 0.68
MEN1 O00255 2/20 0.67
KMT2A Q03164 2/20 0.67
GAA P10253 1/20 0.67
MAPK1 P28482 2/20 0.66

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
SCHEMBL21098369 0.94 SMN1; SMN2 (0.89) SMN1; SMN2NPC1POLBALDH1A1MAPT
SCHEMBL13211944 0.88 SMN1; SMN2 (0.78) SMN1; SMN2NPC1POLBALDH1A1MAPT
SCHEMBL6571604 0.88 SMN1; SMN2 (0.84) SMN1; SMN2NPC1POLBALDH1A1MAPT
SCHEMBL4770380 0.88 SMN1; SMN2 (0.78) SMN1; SMN2NPC1POLBALDH1A1MAPT
SCHEMBL5257694 0.88 SMN1; SMN2 (0.78) SMN1; SMN2NPC1POLBALDH1A1MAPT
SCHEMBL16359671 0.88 SMN1; SMN2 (0.78) SMN1; SMN2NPC1POLBALDH1A1MAPT
SCHEMBL95881 0.88 SMN1; SMN2 (0.78) SMN1; SMN2NPC1POLBALDH1A1MAPT
SCHEMBL1775216 0.88 SMN1; SMN2 (0.82) SMN1; SMN2NPC1POLBALDH1A1MAPT
SCHEMBL13766445 0.86 SMN1; SMN2 (0.74) SMN1; SMN2NPC1POLBALDH1A1MAPT
SCHEMBL13762099 0.86 MEN1 (0.78) SMN1; SMN2NPC1POLBALDH1A1MAPT

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 5 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
EP-1720544-A1 NOVEL AZABICYCLIC DERIVATIVES, PREPARATION METHOD THEREOF AND PHARMACEUTICAL COMPOSITIONS CONTAINING SAME Les Laboratoires Servier (FR) 2006-11-15 EP disclosed
WO-2005089747-A1 NOVEL AZABICYCLIC DERIVATIVES, PREPARATION METHOD THEREOF AND PHARMACEUTICAL COMPOSITIONS CONTAINING SAME LES LABORATOIRES SERVIER (FR) 2005-09-29 WO 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 SMN1; SMN2 855/4885NPC1 2317/4885POLB 387/4885

“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.