SCHEMBL522513

SCHEMBL522513

O=C(c1ccc(CN2CCOCC2)cc1)N1CCNCC1

nearest known ligand 0.75

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
HPGD P15428 1/20 0.75
HRH3 Q9Y5N1 9/20 0.71
GAA P10253 1/20 0.61
SMN1; SMN2 Q16637 1/20 0.60
USP2 O75604 1/20 0.57
TSHR P16473 1/20 0.57
PHGDH O43175 1/20 0.54
SIGMAR1 Q99720 1/20 0.53
HIF1A Q16665 1/20 0.52
EPAS1 Q99814 1/20 0.52
GPR183 P32249 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
SCHEMBL1014002 0.90 HPGD (0.86) HPGDHRH3GAASMN1; SMN2USP2
Tert-Butyl Formate SCHEMBL27719956 0.88 HRH3 (0.60) HPGDHRH3GAASMN1; SMN2USP2
SCHEMBL3456205 0.86 HPGD (1.00) HPGDHRH3GAASMN1; SMN2USP2
SCHEMBL13359565 0.86 LSS (0.59) HPGDHRH3SIGMAR1GPR183
SCHEMBL1450838 0.84 HRH3 (0.78) HPGDHRH3GAASMN1; SMN2USP2
SCHEMBL13636330 0.83 HRH3 (1.00) HPGDHRH3GAASMN1; SMN2USP2
SCHEMBL14567115 0.83 HPGD (0.54) HPGDHRH3SIGMAR1GPR183
SCHEMBL13211156 0.82 HPGD (0.73) HPGDHRH3GAASMN1; SMN2USP2
SCHEMBL10184001 0.82 HRH3 (0.78) HPGDHRH3GAASMN1; SMN2USP2
Hydrochloric Acid SCHEMBL1177194 0.82 HRH3 (0.97) HPGDHRH3GAASMN1; SMN2USP2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120283433-A1 NOVEL PROCESSES FOR THE PREPARATION OF CYCLOPROPYL-AMIDE DERIVATIVES MANI NEELAKANDHA S (US) 2012-11-08 US disclosed
EP-1951699-B1 PROCESSES FOR THE PREPARATION OF CYCLOPROPYL-AMIDE DERIVATIVES JANSSEN PHARMACEUTICA NV (BE) 2012-10-10 EP disclosed
US-20120029191-A1 NOVEL PROCESSES FOR THE PREPARATION OF CYCLOPROPYL-AMIDE DERIVATIVES MANI NEELAKANDHA S (US) 2012-02-02 US disclosed
EP-2404911-A1 Novel processes for the preparation of piperazinyl and diazapanyl benzamide derivatives Janssen Pharmaceutica NV (BE) 2012-01-11 EP disclosed
US-8063206-B2 Processes for the preparation of cyclopropyl-amide derivatives JANSSEN PHARMACEUTICA NV (BE) 2011-11-22 US disclosed
US-8026242-B2 Cyclopropyl amines as modulators of the histamine H3 receptor JANSSEN PHARMACEUTICA NV (BE) 2011-09-27 US disclosed
US-8026242-B2 Cyclopropyl amines as modulators of the histamine H3 receptor JANSSEN PHARMACEUTICA NV (BE) 2011-09-27 US disclosed
US-8026242-B2 Cyclopropyl amines as modulators of the histamine H3 receptor JANSSEN PHARMACEUTICA NV (BE) 2011-09-27 US disclosed
US-20110136797-A1 CYCLOPROPYL AMINES AS MODULATORS OF THE HISTAMINE H3 RECEPTOR JANSSEN PHARMACEUTICA NV (BE) 2011-06-09 US disclosed
US-20110136797-A1 CYCLOPROPYL AMINES AS MODULATORS OF THE HISTAMINE H3 RECEPTOR JANSSEN PHARMACEUTICA NV (BE) 2011-06-09 US disclosed
EP-1948607-A2 CYCLOPROPYL AMINES AS MODULATORS OF THE HISTAMINE H3 RECEPTOR Janssen Pharmaceutica, N.V. (BE) 2008-07-30 EP disclosed
US-20070197508-A1 NOVEL PROCESSES FOR THE PREPARATION OF PIPERAZINYL AND DIAZAPANYL BENZAMIDE DERIVATIVES JANSSEN PHARMACEUTICA N.V. (BE) 2007-08-23 US disclosed
US-20070129351-A1 NOVEL PROCESSES FOR THE PREPARATION OF CYCLOPROPYL-AMIDE DERIVATIVES JANSSEN PHARMACEUTICA N.V. (BE) 2007-06-07 US disclosed
WO-2007053386-A2 PROCESSES FOR THE PREPARATION OF CYCLOPROPYL-AMIDE DERIVATIVES JANSSEN PHARMACEUTICA N.V. (BE) 2007-05-10 WO disclosed
WO-2007053427-A2 NOVEL PROCESSES FOR THE PREPARATION OF PIPERAZINYL AND DIAZAPANYL BENZAMIDE DERIVATIVES JANSSEN PHARMACEUTICA N.V. (BE) 2007-05-10 WO disclosed
WO-2007035425-A2 CYCLOPROPYL AMINES AS MODULATORS OF THE HISTAMINE H3 RECEPTOR JANSSEN PHARMACEUTICA N.V. (BE) 2007-03-29 WO disclosed
WO-2007035425-A2 CYCLOPROPYL AMINES AS MODULATORS OF THE HISTAMINE H3 RECEPTOR JANSSEN PHARMACEUTICA N.V. (BE) 2007-03-29 WO disclosed
US-20070066821-A1 CYCLOPROPYL AMINES AS MODULATORS OF THE HISTAMINE H3 RECEPTOR JANSSEN PHARMACEUTICA, N.V. (BE) 2007-03-22 US disclosed
US-20070066821-A1 CYCLOPROPYL AMINES AS MODULATORS OF THE HISTAMINE H3 RECEPTOR JANSSEN PHARMACEUTICA, N.V. (BE) 2007-03-22 US disclosed
US-20070066821-A1 CYCLOPROPYL AMINES AS MODULATORS OF THE HISTAMINE H3 RECEPTOR JANSSEN PHARMACEUTICA, N.V. (BE) 2007-03-22 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 (6 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-20070197508-A1 NOVEL PROCESSES FOR THE PREPARATION OF PIPERAZINYL AND DIAZAPANYL BENZAMIDE DERIVATIVES HRH2, HRH4, HRH1 HPGD 785/4885HRH3 4/4885GAA 1487/4885
US-20070066821-A1 CYCLOPROPYL AMINES AS MODULATORS OF THE HISTAMINE H3 RECEPTOR HRH3, HRH4, HRH2 HPGD 714/4885HRH3 1/4885GAA 2326/4885
US-20070129351-A1 NOVEL PROCESSES FOR THE PREPARATION OF CYCLOPROPYL-AMIDE DERIVATIVES HRH4, HRH2, HRH1 HPGD 300/4885HRH3 4/4885GAA 1163/4885
US-20120283433-A1 NOVEL PROCESSES FOR THE PREPARATION OF CYCLOPROPYL-AMIDE DERIVATIVES HRH4, HRH2, HRH1 HPGD 300/4885HRH3 4/4885GAA 1163/4885
US-20120029191-A1 NOVEL PROCESSES FOR THE PREPARATION OF CYCLOPROPYL-AMIDE DERIVATIVES HRH4, HRH2, HRH1 HPGD 300/4885HRH3 4/4885GAA 1163/4885
US-20110136797-A1 CYCLOPROPYL AMINES AS MODULATORS OF THE HISTAMINE H3 RECEPTOR HRH3, HRH4, HRH2 HPGD 714/4885HRH3 1/4885GAA 2326/4885

“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.