SCHEMBL6097814

SCHEMBL6097814

c1ccc(OCCCN2CCN(c3cccc(OCc4ccncc4)n3)CC2)cc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 11/20 0.56
HRH1 P35367 7/20 0.56
HRH2 P25021 3/20 0.56
DRD2 P14416 4/20 0.51
DRD3 P35462 4/20 0.51
HTR1A P08908 4/20 0.51
HTR2A P28223 4/20 0.51
TMEM97 Q5BJF2 2/20 0.51
SIGMAR1 Q99720 2/20 0.51
DRD1 P21728 2/20 0.51
ADRA2C P18825 1/20 0.51
DRD5 P21918 1/20 0.51
HTR7 P34969 1/20 0.51
HTT P42858 2/20 0.47
KDM4E B2RXH2 1/20 0.47
ALDH1A1 P00352 1/20 0.47
LMNA P02545 1/20 0.47
HPGD P15428 1/20 0.47
TSHR P16473 1/20 0.47
ALOX12 P18054 1/20 0.47

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
SCHEMBL6098274 0.95 HRH1 (0.49) HRH3HRH1HRH2DRD2DRD3
SCHEMBL6097854 0.88 POLB (0.60) HRH3HRH1DRD2DRD3HTR1A
SCHEMBL6098986 0.86 DRD3 (0.45) HRH3HRH1DRD2DRD3HTR1A
SCHEMBL6101931 0.86 HTR1A (0.47) HRH3HRH1DRD2DRD3HTR1A
SCHEMBL6098835 0.84 MAP4K4 (0.48) DRD3HTR1AHTR2AHTTKDM4E
SCHEMBL6100280 0.83 HRH4 (0.44) DRD2DRD3HTR1AHTR2ASIGMAR1
SCHEMBL6100140 0.83 NPC1 (0.59) HRH3HTR1ASIGMAR1HTR7HTT
SCHEMBL6099408 0.83 HTR1A (0.41) HRH3HRH1DRD2DRD3HTR1A
SCHEMBL6099758 0.81 HRH3 (0.45) HRH3HRH1DRD3HTR1AHTR2A
SCHEMBL6099216 0.81 GLP1R (0.41) HRH3HRH1DRD2DRD3HTR1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7009051-B2 4-(2-pyridyl) piperazines having 5HT7 receptor agonist activity PFIZER INC (US) 2006-03-07 US claimed
US-20040014769-A1 4-(2-Pyridyl)piperazines having 5HT7 receptor agonist activity PFIZER INC. 2004-01-22 US claimed
EP-1254905-B1 4-(2-Pyridyl)piperazines having 5HT7 receptor agonist activity PFIZER PROD INC (US) 2003-12-17 EP claimed
US-20030008880-A1 4-(2-Pyridyl) piperizines having 5HT7 receptor agonist activity PFIZER INC. 2003-01-09 US claimed
EP-1254905-A1 4-(2-Pyridyl)piperazines having 5HT7 receptor agonist activity Pfizer Products Inc. (US) 2002-11-06 EP claimed
US-7009051-B2 4-(2-pyridyl) piperazines having 5HT7 receptor agonist activity PFIZER INC (US) 2006-03-07 US disclosed
US-20040014769-A1 4-(2-Pyridyl)piperazines having 5HT7 receptor agonist activity PFIZER INC. 2004-01-22 US disclosed
EP-1254905-B1 4-(2-Pyridyl)piperazines having 5HT7 receptor agonist activity PFIZER PROD INC (US) 2003-12-17 EP disclosed
US-20030008880-A1 4-(2-Pyridyl) piperizines having 5HT7 receptor agonist activity PFIZER INC. 2003-01-09 US disclosed
EP-1254905-A1 4-(2-Pyridyl)piperazines having 5HT7 receptor agonist activity Pfizer Products Inc. (US) 2002-11-06 EP 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-20040014769-A1 4-(2-Pyridyl)piperazines having 5HT7 receptor agonist activity HTR7, HTR1A, HTR2C HRH3 203/4885HRH1 169/4885HRH2 166/4885
US-20030008880-A1 4-(2-Pyridyl) piperizines having 5HT7 receptor agonist activity HTR7, HTR1A, HTR2C HRH3 196/4885HRH1 162/4885HRH2 174/4885

“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.