SCHEMBL524430

SCHEMBL524430

C1CC(N2CCCNCC2)C1

nearest known ligand 0.71

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 1/20 0.59
HPGD P15428 1/20 0.43
KMT2A Q03164 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
HRH3 Q9Y5N1 3/20 0.37
L3MBTL3 Q96JM7 2/20 0.37
L3MBTL1 Q9Y468 2/20 0.37
CYP2D6 P10635 1/20 0.35
PDE7A Q13946 1/20 0.34
CXCR4 P61073 2/20 0.34
KDM4E B2RXH2 1/20 0.32
ALDH1A1 P00352 1/20 0.32
OPRM1 P35372 1/20 0.32
OPRD1 P41143 1/20 0.32
OPRK1 P41145 1/20 0.32
OGFRL1 Q5TC84 1/20 0.32
HTR2C P28335 1/20 0.32
HTR2B P41595 1/20 0.32

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
Hydrochloric Acid SCHEMBL450486 0.98 HTR6 (0.57) HTR6HPGDKMT2ASMN1; SMN2HRH3
Hydrochloric Acid SCHEMBL4321509 0.98 HTR6 (0.57) HTR6HPGDKMT2ASMN1; SMN2HRH3
SCHEMBL1507120 0.95 HTR6 (0.65) HTR6HPGDKMT2ASMN1; SMN2HRH3
SCHEMBL9902700 0.93 HTR6 (0.63) HTR6HPGDKMT2ASMN1; SMN2HRH3
SCHEMBL6134512 0.93 HTR6 (0.63) HTR6HPGDKMT2ASMN1; SMN2HRH3
SCHEMBL2904654 0.93 HTR6 (0.56) HTR6HPGDKMT2ASMN1; SMN2HRH3
SCHEMBL64117 0.93 HTR6 (0.56) HTR6HPGDKMT2ASMN1; SMN2HRH3
SCHEMBL64201 0.93 HTR6 (0.60) HTR6HPGDKMT2ASMN1; SMN2HRH3
Hydrochloric Acid SCHEMBL31598665 0.91 HTR6 (0.61) HTR6HPGDKMT2ASMN1; SMN2HRH3
Hydrochloric Acid SCHEMBL2973444 0.91 HTR6 (0.54) HTR6HPGDKMT2ASMN1; SMN2HRH3

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 72 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2032536-B1 SUBSTITUTED PYRIDYL AMIDE COMPOUNDS AS MODULATORS OF THE HISTAMINE H3 RECEPTOR JANSSEN PHARMACEUTICA NV (BE) 2015-05-06 EP claimed
EP-3492451-B1 PROCESS FOR THE PREPARATION OF HISTAMINE H3 RECEPTOR MODULATORS JANSSEN PHARMACEUTICA NV (BE) 2021-11-03 EP disclosed
US-10323002-B2 Process for the preparation of histamine H3 receptor modulators JANSSEN PHARMACEUTICA NV (BE) 2019-06-18 US disclosed
US-10323002-B2 Process for the preparation of histamine H3 receptor modulators JANSSEN PHARMACEUTICA NV (BE) 2019-06-18 US disclosed
EP-3492451-A2 PROCESS FOR THE PREPARATION OF HISTAMINE H3 RECEPTOR MODULATORS Janssen Pharmaceutica NV (BE) 2019-06-05 EP disclosed
EP-3492451-A2 PROCESS FOR THE PREPARATION OF HISTAMINE H3 RECEPTOR MODULATORS Janssen Pharmaceutica NV (BE) 2019-06-05 EP disclosed
EP-3216784-B1 PROCESS FOR THE PREPARATION OF HISTAMINE H3 RECEPTOR MODULATORS JANSSEN PHARMACEUTICA NV (BE) 2018-12-26 EP disclosed
US-20180022704-A1 PROCESS FOR THE PREPARATION OF HISTAMINE H3 RECEPTOR MODULATORS JANSSEN PHARMACEUTICA NV (BE) 2018-01-25 US disclosed
US-20180022704-A1 PROCESS FOR THE PREPARATION OF HISTAMINE H3 RECEPTOR MODULATORS JANSSEN PHARMACEUTICA NV (BE) 2018-01-25 US disclosed
US-20180022704-A1 PROCESS FOR THE PREPARATION OF HISTAMINE H3 RECEPTOR MODULATORS JANSSEN PHARMACEUTICA NV (BE) 2018-01-25 US disclosed
US-20100130477-A1 Spirocyclobutyl Piperidine Derivatives ASTRAZENECA AB (SE) 2010-05-27 US disclosed
US-20100130477-A1 Spirocyclobutyl Piperidine Derivatives ASTRAZENECA AB (SE) 2010-05-27 US disclosed
WO-2009143153-A1 SUBSTITUTED PYRROLIDINE AMIDES AS MODULATORS OF THE HISTAMINE H3 RECEPTOR JANSSEN PHARMACEUTICA NV (BE) 2009-11-26 WO disclosed
WO-2009135842-A1 AZETIDINES AND CYCLOBUTANES AS HISTAMINE H3 RECEPTOR ANTAGONISTS EVOTEC NEUROSCIENCES GMBH (DE) 2009-11-12 WO disclosed
WO-2009135842-A1 AZETIDINES AND CYCLOBUTANES AS HISTAMINE H3 RECEPTOR ANTAGONISTS EVOTEC NEUROSCIENCES GMBH (DE) 2009-11-12 WO disclosed
WO-2009095394-A1 DIAZEPANES AS HISTAMINE H3 RECEPTOR ANTAGONISTS EVOTEC NEUROSCIENCES GMBH (DE) 2009-08-06 WO disclosed
WO-2009095394-A1 DIAZEPANES AS HISTAMINE H3 RECEPTOR ANTAGONISTS EVOTEC NEUROSCIENCES GMBH (DE) 2009-08-06 WO disclosed
US-20080045505-A1 1-Benzoyl Substituted Diazepine Derivatives As Selective Histamine H3 Receptor Agonists GLAXO GROUP LIMITED (GB) 2008-02-21 US disclosed
EP-1675838-A1 1-BENZOYL SUBSTITUTED DIAZEPINE DERIVATIVES AS SELECTIVE HISTAMINE H3 RECEPTOR AGONISTS GLAXO GROUP LIMITED (GB) 2006-07-05 EP disclosed
WO-2005040144-A1 NOVEL COMPOUNDS GLAXO GROUP LIMITED (GB) 2005-05-06 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 (4 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-10323002-B2 Process for the preparation of histamine H3 receptor modulators HRH3, HRH4, HRH1 HTR6 15/4885HPGD 874/4885KMT2A 132/4885
US-20180022704-A1 PROCESS FOR THE PREPARATION OF HISTAMINE H3 RECEPTOR MODULATORS HRH3, HRH4, HRH1 HTR6 15/4885HPGD 874/4885KMT2A 132/4885
US-20100130477-A1 Spirocyclobutyl Piperidine Derivatives HRH3, HRH4, HRH2 HTR6 94/4885HPGD 903/4885KMT2A 521/4885
US-20080045505-A1 1-Benzoyl Substituted Diazepine Derivatives As Selective Histamine H3 Receptor Agonists HRH3, HRH4, HRH1 HTR6 54/4885HPGD 595/4885KMT2A 416/4885

“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.