SCHEMBL2883340

SCHEMBL2883340

O=C(c1ccccc1Cn1cnc2ccccc21)N1CCC(N2CCCCC2)C1

nearest known ligand 0.98

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 13/20 0.98
L3MBTL3 Q96JM7 4/20 0.48
L3MBTL1 Q9Y468 4/20 0.48
TP53BP1 Q12888 2/20 0.48
MEN1 O00255 1/20 0.46
KMT2A Q03164 1/20 0.46
MBTD1 Q05BQ5 1/20 0.43
CYP11B1 P15538 1/20 0.42
CYP11B2 P19099 1/20 0.42

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
SCHEMBL13085882 0.85 HRH3 (0.74) HRH3CYP11B1CYP11B2
SCHEMBL2883533 0.83 HRH3 (1.00) HRH3L3MBTL3L3MBTL1MBTD1
SCHEMBL2884617 0.83 HRH3 (1.00) HRH3L3MBTL3L3MBTL1MBTD1
SCHEMBL2883981 0.82 HRH3 (0.74) HRH3L3MBTL3L3MBTL1TP53BP1MEN1
SCHEMBL2886484 0.81 HRH3 (0.72) HRH3CYP11B1CYP11B2
SCHEMBL13085768 0.80 HRH3 (0.65) HRH3L3MBTL1CYP11B1CYP11B2
SCHEMBL2885133 0.80 HRH3 (0.89) HRH3MEN1KMT2A
Hydrochloric Acid SCHEMBL2884193 0.79 HRH3 (0.64) HRH3L3MBTL1CYP11B1CYP11B2
SCHEMBL2884990 0.78 HRH3 (0.91) HRH3MEN1KMT2A
SCHEMBL2884190 0.75 HRH3 (0.84) HRH3

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 disclosed
US-7820825-B2 N-substituted-azacyclylamines as histamine-3 antagonists WYETH LLC (US) 2010-10-26 US disclosed
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
US-20070219240-A1 N-substituted-azacyclylamines as histamine-3 antagonists WYETH (US) 2007-09-20 US 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 3/4885L3MBTL3 3550/4885L3MBTL1 4513/4885

“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.