SCHEMBL2884414

SCHEMBL2884414

Clc1cc(CN2CCC(N3CCCCC3)C2)ccc1Cn1cnc2ccccc21

nearest known ligand 0.56

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 7/20 0.56
CYP11B1 P15538 4/20 0.44
CYP11B2 P19099 4/20 0.44
HTT P42858 3/20 0.44
SMN1; SMN2 Q16637 2/20 0.44
MAPK1 P28482 1/20 0.44
TNF P01375 2/20 0.41
LMNA P02545 2/20 0.41
SIGMAR1 Q99720 3/20 0.40
CCR3 P51677 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
SCHEMBL2883537 0.99 HRH3 (0.57) HRH3CYP11B1CYP11B2HTTSMN1; SMN2
SCHEMBL13085875 0.88 HRH3 (0.69) HRH3CYP11B1CYP11B2HTTSMN1; SMN2
SCHEMBL2884865 0.88 HRH3 (0.69) HRH3CYP11B1CYP11B2HTTSMN1; SMN2
Hydrochloric Acid SCHEMBL2884735 0.87 HRH3 (0.68) HRH3CYP11B1CYP11B2HTTSMN1; SMN2
SCHEMBL13085768 0.85 HRH3 (0.65) HRH3CYP11B1CYP11B2HTTSMN1; SMN2
Hydrochloric Acid SCHEMBL2884193 0.84 HRH3 (0.64) HRH3CYP11B1CYP11B2HTTSMN1; SMN2
SCHEMBL2886689 0.82 HRH3 (0.57) HRH3CYP11B1CYP11B2HTTSMN1; SMN2
SCHEMBL2884425 0.80 HRH3 (0.49) HRH3CYP11B1CYP11B2HTTSMN1; SMN2
SCHEMBL1814415 0.79 HRH3 (0.52) HRH3HTT
SCHEMBL2891615 0.79 BACE1 (0.42) HRH3CYP11B1CYP11B2HTTSMN1; SMN2

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 3/4885CYP11B1 2856/4885CYP11B2 2197/4885

“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.