SCHEMBL2881996

SCHEMBL2881996

O=C(c1ccc(Cn2cnc3cc(F)ccc32)cc1)N1CCC(N2CCCC2)C1

nearest known ligand 0.76

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 15/20 0.76
L3MBTL1 Q9Y468 4/20 0.52
L3MBTL3 Q96JM7 3/20 0.52
MBTD1 Q05BQ5 1/20 0.50
KDM4E B2RXH2 1/20 0.50
MEN1 O00255 1/20 0.50
ALDH1A1 P00352 1/20 0.50
KMT2A Q03164 1/20 0.50

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
SCHEMBL2883568 1.00 HRH3 (0.76) HRH3L3MBTL1L3MBTL3MBTD1KDM4E
SCHEMBL2879070 0.93 HRH3 (0.76) HRH3L3MBTL1L3MBTL3MBTD1KDM4E
SCHEMBL2886808 0.90 HRH3 (0.78) HRH3L3MBTL1L3MBTL3MBTD1
SCHEMBL2884664 0.89 HRH3 (0.76) HRH3L3MBTL1L3MBTL3MBTD1
SCHEMBL2884245 0.88 HRH3 (0.75) HRH3L3MBTL1L3MBTL3MBTD1
Hydrochloric Acid SCHEMBL2886398 0.88 HRH3 (0.75) HRH3L3MBTL1L3MBTL3MBTD1
SCHEMBL2881412 0.88 HRH3 (0.75) HRH3L3MBTL1L3MBTL3MBTD1
SCHEMBL2884656 0.87 HRH3 (0.73) HRH3L3MBTL1L3MBTL3MBTD1
SCHEMBL2883672 0.87 HRH3 (0.58) HRH3
SCHEMBL2886645 0.87 HRH3 (0.58) 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 4 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-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 3/4885L3MBTL1 4513/4885L3MBTL3 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.