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SCHEMBL3724693

SCHEMBL3724693

Cc1nc2ccccc2n1-c1ccc(C(=O)N(C)C2CCN(C3CCC3)CC2)cc1.Cc1nc2ccccc2n1-c1ccc(C(=O)N(C)C2CCN(C3CCCC3)CC2)cc1.Cc1nc2ccccc2n1-c1ccc(C(=O)N(C)C2CCN(C3CCCCC3)CC2)cc1

nearest known ligand 0.88

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ HRH3 Q9Y5N1 19/20 0.88
▸ KCNH2 Q12809 3/20 0.88
▸ PTAFR P25105 1/20 0.61

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
SCHEMBL3727716 0.99 HRH3 (0.89) HRH3KCNH2PTAFR
SCHEMBL4944250 0.98 HRH3 (0.89) HRH3KCNH2PTAFR
SCHEMBL3725733 0.98 HRH3 (0.89) HRH3KCNH2PTAFR
SCHEMBL3667982 0.93 HRH3 (1.00) HRH3KCNH2
SCHEMBL3738453 0.93 HRH3 (1.00) HRH3KCNH2
SCHEMBL7759667 0.93 HRH3 (1.00) HRH3KCNH2
SCHEMBL3726319 0.93 HRH3 (1.00) HRH3KCNH2
Hydrochloric Acid SCHEMBL4943272 0.93 HRH3 (0.98) HRH3KCNH2
SCHEMBL3672189 0.92 HRH3 (1.00) HRH3KCNH2
SCHEMBL3724761 0.92 HRH3 (1.00) HRH3KCNH2

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2155719-A1 AZACYCLYLBENZAMIDE DERIVATIVES AS HISTAMINE-3 ANTAGONISTS Wyeth LLC (US) 2010-02-24 — — EP disclosed
WO-2008147945-A1 AZACYCLYLBENZAMIDE DERIVATIVES AS HISTAMINE-3 ANTAGONISTS WYETH (US) 2008-12-04 — — WO disclosed