SCHEMBL2886669

SCHEMBL2886669

O=C(c1ccc(Cc2nc3ccccc3n2CCc2ccccc2)cc1)N1CC[C@H](N2CCCC2)C1

nearest known ligand 0.67

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 15/20 0.67
L3MBTL3 Q96JM7 2/20 0.50
L3MBTL1 Q9Y468 2/20 0.50
MBTD1 Q05BQ5 1/20 0.47
TSHR P16473 1/20 0.47
MAPK1 P28482 1/20 0.47

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
Fumaric Acid SCHEMBL2884241 0.96 HRH3 (0.62) HRH3L3MBTL3L3MBTL1MBTD1
Fumaric Acid SCHEMBL2884243 0.96 HRH3 (0.62) HRH3L3MBTL3L3MBTL1MBTD1
SCHEMBL2886056 0.92 HRH3 (0.67) HRH3L3MBTL3L3MBTL1
SCHEMBL2884880 0.91 HRH3 (0.69) HRH3L3MBTL3L3MBTL1
SCHEMBL2884415 0.90 HRH3 (0.67) HRH3L3MBTL3L3MBTL1
SCHEMBL2878753 0.89 HRH3 (0.71) HRH3L3MBTL3L3MBTL1
SCHEMBL2884371 0.89 HRH3 (0.71) HRH3L3MBTL3L3MBTL1
Fumaric Acid SCHEMBL2879166 0.89 HRH3 (0.62) HRH3L3MBTL3L3MBTL1
Fumaric Acid SCHEMBL2879169 0.89 HRH3 (0.62) HRH3L3MBTL3L3MBTL1
Hydrochloric Acid SCHEMBL2885717 0.88 HRH3 (0.70) HRH3L3MBTL3L3MBTL1

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 9 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
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
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
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.