SCHEMBL6099758

SCHEMBL6099758

CCN1CCN(c2cccc(OCc3ccncc3)n2)CC1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 1/20 0.45
HRH4 Q9H3N8 2/20 0.43
ALDH1A1 P00352 4/20 0.42
SMN1; SMN2 Q16637 3/20 0.42
HTT P42858 3/20 0.42
KDM4E B2RXH2 3/20 0.42
LMNA P02545 3/20 0.42
TSHR P16473 2/20 0.42
HPGD P15428 1/20 0.42
ALOX12 P18054 1/20 0.42
NPC1 O15118 2/20 0.41
MAPT P10636 2/20 0.41
RAB9A P51151 1/20 0.41
KIT P10721 3/20 0.41
FLT3 P36888 3/20 0.41
GLP1R P43220 1/20 0.41
MEN1 O00255 1/20 0.40
TP53 P04637 1/20 0.40
KMT2A Q03164 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40

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
SCHEMBL6100280 0.90 HRH4 (0.44) HRH4ALDH1A1SMN1; SMN2HTTKDM4E
SCHEMBL6098986 0.88 DRD3 (0.45) HRH3HRH4HTR2AHTR2CHTR1A
SCHEMBL6099613 0.87 HRH4 (0.56) HRH3HRH4ALDH1A1TSHRHTR2A
SCHEMBL6098835 0.86 MAP4K4 (0.48) HRH4ALDH1A1SMN1; SMN2HTTKDM4E
SCHEMBL6100140 0.85 NPC1 (0.59) HRH3HRH4ALDH1A1SMN1; SMN2HTT
SCHEMBL6097963 0.84 HRH3 (0.44) HRH3HRH4ALDH1A1SMN1; SMN2HTT
SCHEMBL6101931 0.83 HTR1A (0.47) HRH3HRH4ALDH1A1SMN1; SMN2HTT
SCHEMBL6099980 0.83 ALDH1A1 (0.61) ALDH1A1SMN1; SMN2HTTKDM4ELMNA
SCHEMBL6099216 0.82 GLP1R (0.41) HRH3HRH4ALDH1A1SMN1; SMN2HTT
SCHEMBL6096996 0.82 KDM4E (0.52) ALDH1A1SMN1; SMN2HTTKDM4ELMNA

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 203/4885HRH4 170/4885ALDH1A1 1531/4885
US-20030008880-A1 4-(2-Pyridyl) piperizines having 5HT7 receptor agonist activity HTR7, HTR1A, HTR2C HRH3 196/4885HRH4 145/4885ALDH1A1 1581/4885

“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.