SCHEMBL6317205

SCHEMBL6317205

N#Cc1ccc(C(O)CN2CC3CC(C2)CN(C(=O)O)C3)cc1

nearest known ligand 0.51

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
GRIN2B Q13224 11/20 0.51
GRIN1 Q05586 6/20 0.51
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
ALDH1A1 P00352 1/20 0.38
KDM4E B2RXH2 3/20 0.36
GAA P10253 1/20 0.36
MAPT P10636 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
F2R P25116 1/20 0.36

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
SCHEMBL6620819 0.91 GRIN2B (0.43) GRIN2BGRIN1MEN1KMT2AALDH1A1
SCHEMBL6990992 0.90 GRIN2B (0.59) GRIN2BGRIN1MEN1KMT2A
SCHEMBL6620971 0.88 HRH1 (0.41) GRIN2BGRIN1ALDH1A1KDM4EGAA
SCHEMBL6316829 0.87 GRIN1 (0.38) GRIN2BGRIN1MEN1KMT2AALDH1A1
SCHEMBL6316782 0.87 GRIN1 (0.38) GRIN2BGRIN1ALDH1A1KDM4EGAA
SCHEMBL6737928 0.84 GRIN2B (0.46) GRIN2BGRIN1MEN1KMT2AALDH1A1
SCHEMBL6621946 0.82 MMP12 (0.50) MEN1ALDH1A1L3MBTL1
SCHEMBL6316375 0.82 GRIN1 (0.37) GRIN2BGRIN1ALDH1A1KDM4EGAA
SCHEMBL6325320 0.82 CCR5 (0.37) GRIN2BGRIN1ALDH1A1KDM4EGAA
SCHEMBL6619543 0.81 MEN1 (0.53) GRIN2BGRIN1MEN1KMT2AALDH1A1

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-6887881-B1 Bispidine compounds useful in the treatment of cardiac arrythmias ASTRAZENECA AB (SE) 2005-05-03 US disclosed
EP-1047695-B1 NOVEL BISPIDINE ANTIARRHYTHMIC COMPOUNDS ASTRAZENECA AB (SE) 2004-03-17 EP disclosed
EP-1192154-B1 BISPIDINE COMPOUNDS USEFUL IN THE TREATMENT OF CARDIAC ARRHYTHMIAS 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
EP-1047695-A1 NOVEL BISPIDINE ANTIARRHYTHMIC COMPOUNDS AstraZeneca AB (SE) 2000-11-02 EP disclosed
WO-1999031100-A1 NOVEL BISPIDINE ANTIARRHYTHMIC COMPOUNDS ASTRAZENECA AB (SE) 1999-06-24 WO disclosed