SCHEMBL5171657

SCHEMBL5171657

CNC(=O)c1cn(Cc2ccc3c(c2)CCN(C(=O)O)CC3CC(C)C)cn1

nearest known ligand 0.36

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ USP30 Q70CQ3 1/20 0.36
▸ KLKB1 P03952 5/20 0.33
▸ SNRNP200 O75643 2/20 0.33
▸ RIPK1 Q13546 1/20 0.33
▸ SCD O00767 1/20 0.33
▸ RBP4 P02753 1/20 0.33
▸ BRD4 O60885 1/20 0.33
▸ F10 P00742 1/20 0.32

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
SCHEMBL5171897 0.87 NOTUM (0.35) USP30SNRNP200SCDRBP4
SCHEMBL5172261 0.84 KLKB1 (0.38) USP30KLKB1RIPK1SCDRBP4
SCHEMBL5171053 0.83 HRH3 (0.35) SCDBRD4
SCHEMBL5171322 0.81 FNTA (0.34) —
SCHEMBL5171939 0.80 HRH3 (0.40) —
SCHEMBL5172025 0.80 HRH3 (0.39) —
SCHEMBL5169168 0.79 PRMT5 (0.37) —
SCHEMBL5170176 0.77 SLC18A2 (0.36) —
SCHEMBL5194064 0.77 HRH3 (0.40) —
SCHEMBL5170187 0.77 SLC18A2 (0.36) —

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-1778643-A1 TETRAHYDROBENZAZEPINES AS ANTAGONISTS AND/OR REVERSE AGONISTS OF THE HISTAMINE H3 RECEPTOR GLAXO GROUP LIMITED (GB) 2007-05-02 — — EP disclosed
WO-2006018260-A1 TETRAHYDROBENZAZEPINES AS ANTAGONISTS AND/OR REVERSE AGONISTS OF THE HISTAMINE H 3 RECEPTOR GLAXO GROUP LIMITED (GB) 2006-02-23 — — WO disclosed
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