SCHEMBL2886402

SCHEMBL2886402

Cc1nc2ccc(Cl)cc2n1[C@@H](C)c1ccc(C(=O)N2CC[C@H](N3CCCC3)C2)cc1

nearest known ligand 0.57

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 11/20 0.57
L3MBTL3 Q96JM7 8/20 0.50
L3MBTL1 Q9Y468 8/20 0.50
MBTD1 Q05BQ5 4/20 0.43
TP53BP1 Q12888 1/20 0.43
L3MBTL4 Q8NA19 1/20 0.43
KDM4E B2RXH2 1/20 0.41
MEN1 O00255 1/20 0.41
ALDH1A1 P00352 1/20 0.41
KMT2A Q03164 1/20 0.41

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
SCHEMBL2878841 1.00 HRH3 (0.57) HRH3L3MBTL3L3MBTL1MBTD1TP53BP1
SCHEMBL2885504 0.94 HRH3 (0.54) HRH3L3MBTL3L3MBTL1MBTD1TP53BP1
SCHEMBL2879601 0.94 HRH3 (0.54) HRH3L3MBTL3L3MBTL1MBTD1TP53BP1
SCHEMBL2887544 0.94 HRH3 (0.54) HRH3L3MBTL3L3MBTL1MBTD1TP53BP1
SCHEMBL2881648 0.88 HRH3 (0.70) HRH3L3MBTL3L3MBTL1MBTD1TP53BP1
SCHEMBL4765310 0.88 HRH3 (0.70) HRH3L3MBTL3L3MBTL1MBTD1TP53BP1
SCHEMBL2886245 0.88 HRH3 (0.70) HRH3L3MBTL3L3MBTL1MBTD1TP53BP1
SCHEMBL2881363 0.86 PADI4 (0.42) HRH3
SCHEMBL2881431 0.86 PADI4 (0.42) HRH3
SCHEMBL5483868 0.86 HPGD (0.48) HRH3L3MBTL3L3MBTL1MEN1ALDH1A1

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 6 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
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.