SCHEMBL5183239

SCHEMBL5183239

CC(C)(C)C1CN(C(=O)O)CCc2cc(Cc3cnc(C(N)=O)cn3)ccc21

nearest known ligand 0.32

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ GRM2 Q14416 1/20 0.32
▸ XIAP P98170 1/20 0.32
▸ BIRC2 Q13490 1/20 0.32
▸ BDKRB1 P46663 1/20 0.30

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
SCHEMBL5171051 0.91 HRH3 (0.35) XIAPBIRC2BDKRB1
SCHEMBL5170762 0.90 SMO (0.33) XIAPBIRC2BDKRB1
SCHEMBL5170763 0.90 XIAP (0.32) XIAPBIRC2BDKRB1
SCHEMBL5170240 0.89 HRH3 (0.35) BDKRB1
SCHEMBL5173427 0.85 ACKR3 (0.36) BDKRB1
SCHEMBL5183097 0.85 CHEK1 (0.31) XIAPBIRC2BDKRB1
SCHEMBL5183241 0.84 HRH3 (0.33) GRM2XIAPBIRC2
SCHEMBL5169161 0.82 PRMT5 (0.36) —
SCHEMBL5171673 0.82 PANK3 (0.37) —
SCHEMBL5170212 0.81 BDKRB1 (0.30) BDKRB1

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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