SCHEMBL2884789

SCHEMBL2884789

CN(C)C1CCN(C(=O)c2ccc(Cn3ccnc3-c3ccccc3)cc2)C1

nearest known ligand 0.66

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 12/20 0.66
ATR Q13535 3/20 0.49
L3MBTL3 Q96JM7 1/20 0.46
PDK2 Q15119 1/20 0.44
OPRD1 P41143 2/20 0.44
HDAC1 Q13547 1/20 0.43
OPRK1 P41145 1/20 0.43

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
SCHEMBL1809344 0.83 HRH3 (0.56) HRH3ATRL3MBTL3PDK2
SCHEMBL2881658 0.79 HRH3 (1.00) HRH3
SCHEMBL2878779 0.79 HRH3 (1.00) HRH3
SCHEMBL2885885 0.79 HRH3 (1.00) HRH3
SCHEMBL2887208 0.79 HRH3 (0.62) HRH3ATRL3MBTL3
SCHEMBL2883495 0.78 HRH3 (1.00) HRH3HDAC1
SCHEMBL2879020 0.78 HRH3 (0.69) HRH3L3MBTL3HDAC1
SCHEMBL10293598 0.76 L3MBTL3 (0.69) HRH3ATRL3MBTL3PDK2
SCHEMBL10293555 0.76 L3MBTL3 (0.69) HRH3ATRL3MBTL3PDK2
SCHEMBL13085781 0.75 L3MBTL3 (0.64) HRH3L3MBTL3PDK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7820825-B2 N-substituted-azacyclylamines as histamine-3 antagonists WYETH LLC (US) 2010-10-26 US claimed
EP-1994022-A2 N-SUBSTITUTED-AZACYCLYLAMINES AS HISTAMINE-3 ANTAGONISTS Wyeth a Corporation of the State of Delaware (US) 2008-11-26 EP claimed
WO-2007108936-A2 N-SUBSTITUTED-AZACYCLYLAMINES AS HISTAMINE-3 ANTAGONISTS WYETH (US) 2007-09-27 WO claimed
US-20070219240-A1 N-substituted-azacyclylamines as histamine-3 antagonists WYETH (US) 2007-09-20 US claimed
US-7820825-B2 N-substituted-azacyclylamines as histamine-3 antagonists WYETH LLC (US) 2010-10-26 US disclosed
EP-1994022-A2 N-SUBSTITUTED-AZACYCLYLAMINES AS HISTAMINE-3 ANTAGONISTS Wyeth a Corporation of the State of Delaware (US) 2008-11-26 EP disclosed
WO-2007108936-A2 N-SUBSTITUTED-AZACYCLYLAMINES AS HISTAMINE-3 ANTAGONISTS WYETH (US) 2007-09-27 WO disclosed
US-20070219240-A1 N-substituted-azacyclylamines as histamine-3 antagonists WYETH (US) 2007-09-20 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 (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-20070219240-A1 N-substituted-azacyclylamines as histamine-3 antagonists HNMT, HRH4, HRH3 HRH3 3/4885ATR 4554/4885L3MBTL3 3550/4885

“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.