SCHEMBL5213102

SCHEMBL5213102

N#Cc1ccc(N2CCC(OC3CCN(C4CCC4)CC3)CC2)c(F)c1

nearest known ligand 0.50

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 3/20 0.50
SLC6A9 P48067 7/20 0.44
ALK Q9UM73 1/20 0.42
GPR6 P46095 4/20 0.40
KCNH2 Q12809 1/20 0.40
CHRM4 P08173 1/20 0.39
PARP1 P09874 2/20 0.38
TNK1 Q13470 2/20 0.38
TNK2 Q07912 1/20 0.38
GPR119 Q8TDV5 1/20 0.38

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
SCHEMBL5208026 0.82 HRH3 (0.40) HRH3ALKGPR6KCNH2CHRM4
SCHEMBL14431500 0.81 ACACB (0.42) HRH3
SCHEMBL5209493 0.80 HRH3 (0.60) HRH3KCNH2
Hydrochloric Acid SCHEMBL5214091 0.79 HRH3 (0.59) HRH3KCNH2
SCHEMBL5211400 0.77 L3MBTL1 (0.51) HRH3SLC6A9
SCHEMBL5211950 0.76 IDO1 (0.44) HRH3CHRM4PARP1TNK1TNK2
SCHEMBL4705699 0.75 SLC6A9 (0.40) HRH3SLC6A9CHRM4
SCHEMBL22570962 0.75 CHRM4 (0.47) SLC6A9KCNH2CHRM4
SCHEMBL5210864 0.75 HRH3 (0.51) HRH3KCNH2PARP1GPR119
SCHEMBL15117102 0.74 SLC6A9 (0.57) SLC6A9

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
EP-1646620-B1 SUBSTITUTED PIPERIDINES AS HISTAMINE H3 RECEPTOR LIGANDS GLAXO GROUP LTD (GB) 2007-08-15 EP claimed
EP-1646620-B1 SUBSTITUTED PIPERIDINES AS HISTAMINE H3 RECEPTOR LIGANDS GLAXO GROUP LTD (GB) 2007-08-15 EP disclosed
US-20060247227-A1 Substituted piperidines as histamine h3 receptor ligands BAILEY JAMES M 2006-11-02 US disclosed
EP-1646620-A1 SUBSTITUTED PIPERIDINES AS HISTAMINE H3 RECEPTOR LIGANDS GLAXO GROUP LIMITED (GB) 2006-04-19 EP disclosed
WO-2005014571-A1 SUBSTITUTED PIPERIDINES AS HISTAMINE H3 RECEPTOR LIGANDS GLAXO GROUP LIMITED (GB) 2005-02-17 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-20060247227-A1 Substituted piperidines as histamine h3 receptor ligands HRH3, HRH4, HRH1 HRH3 1/4885SLC6A9 2528/4885ALK 1238/4885

“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.