SCHEMBL6622255

SCHEMBL6622255

CC(C)(C)OC(=O)N1CC2CC(CN(CCOc3ccc(C#N)cc3)C2)C1

nearest known ligand 0.72

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 5/20 0.49
KCNA5 P22460 4/20 0.47
EPHX2 P34913 3/20 0.45
HRH2 P25021 3/20 0.44
HRH1 P35367 3/20 0.44
HRH3 Q9Y5N1 3/20 0.44
EGLN2 Q96KS0 1/20 0.43

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
SCHEMBL6095505 0.89 GPR119 (0.51) GPR119KCNA5HRH2HRH1HRH3
SCHEMBL2964527 0.86 GPR119 (0.48) GPR119KCNA5HRH2HRH1HRH3
SCHEMBL6619506 0.84 EPHX2 (0.51) GPR119EPHX2HRH2HRH1HRH3
SCHEMBL29388816 0.84 KCNH2 (0.48) GPR119EGLN2
SCHEMBL6622413 0.84 KCNH2 (0.48) GPR119EGLN2
SCHEMBL6614408 0.83 GPR119 (0.46) GPR119EPHX2EGLN2
SCHEMBL7028501 0.83 KCNA5 (0.47) KCNA5HRH2HRH1HRH3
SCHEMBL6986222 0.82 GPR119 (0.42) GPR119EPHX2HRH2HRH1EGLN2
SCHEMBL6621606 0.82 GPR119 (0.45) GPR119EPHX2EGLN2
SCHEMBL5965653 0.82 GPR119 (0.53) GPR119KCNA5HRH2HRH1HRH3

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-1047695-B1 NOVEL BISPIDINE ANTIARRHYTHMIC COMPOUNDS ASTRAZENECA AB (SE) 2004-03-17 EP disclosed
US-6291475-B1 3,7-DIAZABICYCLO(3.3.1)NONANE DERIVATIVES ASTRAZENECA AB (SE) 2001-09-18 US disclosed