SCHEMBL5207650

SCHEMBL5207650

c1ccc(CN2CCC(Oc3ccc(CN4CCOCC4)cc3)CC2)cc1

nearest known ligand 0.70

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 10/20 0.70
SMN1; SMN2 Q16637 3/20 0.64
GAA P10253 1/20 0.64
ROCK1 Q13464 2/20 0.55
ROCK2 O75116 1/20 0.55
CCR2 P41597 1/20 0.55
MAOA P21397 1/20 0.54
MAOB P27338 1/20 0.54
KDM4E B2RXH2 1/20 0.53
ALDH1A1 P00352 1/20 0.53
HPGD P15428 1/20 0.53
HTT P42858 1/20 0.53
OPRK1 P41145 1/20 0.53
NPC1 O15118 1/20 0.51
RAB9A P51151 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
SCHEMBL7179044 0.94 HRH3 (0.67) HRH3SMN1; SMN2GAAROCK1ROCK2
SCHEMBL4855546 0.87 HRH3 (0.74) HRH3SMN1; SMN2GAAROCK1ROCK2
SCHEMBL5203366 0.86 HRH3 (0.69) HRH3SMN1; SMN2GAAROCK1ROCK2
SCHEMBL5202949 0.85 HRH3 (0.70) HRH3SMN1; SMN2GAA
SCHEMBL7179085 0.85 HRH3 (0.62) HRH3SMN1; SMN2GAAMAOAMAOB
SCHEMBL7197267 0.85 HRH3 (0.65) HRH3SMN1; SMN2GAAMAOAMAOB
SCHEMBL13463052 0.84 HRH3 (0.70) HRH3SMN1; SMN2GAAROCK1ROCK2
SCHEMBL5202774 0.84 HRH3 (0.76) HRH3SMN1; SMN2GAA
SCHEMBL3022526 0.84 HRH3 (0.71) HRH3SMN1; SMN2GAAROCK1ROCK2
SCHEMBL8393625 0.84 HRH3 (0.71) HRH3SMN1; SMN2GAAROCK1ROCK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7241778-B2 Non-imidazole aryloxypiperidines ORTHO MCNEIL PHARMACEUTICAL, INC (US) 2007-07-10 US disclosed
US-7241778-B2 Non-imidazole aryloxypiperidines ORTHO MCNEIL PHARMACEUTICAL, INC (US) 2007-07-10 US disclosed
US-7241778-B2 Non-imidazole aryloxypiperidines ORTHO MCNEIL PHARMACEUTICAL, INC (US) 2007-07-10 US disclosed
EP-1311482-B1 NON-IMIDAZOLE ARYLOXYPIPERIDINES AS H3 RECEPTOR LIGANDS ORTHO MCNEIL PHARM INC (US) 2007-02-21 EP disclosed
EP-1311482-B1 NON-IMIDAZOLE ARYLOXYPIPERIDINES AS H3 RECEPTOR LIGANDS ORTHO MCNEIL PHARM INC (US) 2007-02-21 EP disclosed
US-7071191-B2 Non-imidazole aryloxypiperidines ORTHO-MCNEIL PHARMACEUTICAL, INC. (US) 2006-07-04 US disclosed
US-20050227979-A1 Non-imidazole aryloxypiperidines APODACA RICHARD 2005-10-13 US disclosed
US-20020040024-A1 Non-imidazole aryloxypiperidines NORTEL NETWORKS LIMITED (CA) 2002-04-04 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 (2 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-20020040024-A1 Non-imidazole aryloxypiperidines HRH2, HRH4, HRH3 HRH3 3/4885SMN1; SMN2 3177/4885GAA 1168/4885
US-20050227979-A1 Non-imidazole aryloxypiperidines HRH2, HRH4, HRH3 HRH3 3/4885SMN1; SMN2 3177/4885GAA 1168/4885

“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.