SCHEMBL6316162

SCHEMBL6316162

CC12CN(Cc3ccccc3)CC(C)(CN(Cc3ccccc3)C1)C2O

nearest known ligand 0.57

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.57
MEN1 O00255 1/20 0.57
TSHR P16473 1/20 0.57
KMT2A Q03164 1/20 0.57
ALDH1A1 P00352 2/20 0.53
FUCA1 P04066 2/20 0.51
SIGMAR1 Q99720 1/20 0.48
TP53 P04637 1/20 0.47
ACHE P22303 1/20 0.47
MC4R P32245 1/20 0.46
HTR1A P08908 2/20 0.44

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
SCHEMBL6324844 0.89 GAA (0.51) GAAMEN1TSHRKMT2AALDH1A1
SCHEMBL6319658 0.89 GAA (0.54) GAAMEN1TSHRKMT2AALDH1A1
SCHEMBL6318216 0.83 GAA (0.45) GAAMEN1TSHRKMT2AALDH1A1
SCHEMBL28612690 0.79 GAA (0.62) GAAMEN1TSHRKMT2AFUCA1
SCHEMBL28349386 0.79 GAA (0.62) GAAMEN1TSHRKMT2AFUCA1
SCHEMBL10990414 0.79 GAA (0.67) GAAMEN1TSHRKMT2AFUCA1
SCHEMBL12358688 0.77 FUCA1 (0.50) GAAMEN1TSHRKMT2AALDH1A1
SCHEMBL19463297 0.76 GAA (0.59) GAAMEN1TSHRKMT2AALDH1A1
SCHEMBL14372131 0.76 GAA (0.59) GAAMEN1TSHRKMT2AFUCA1
SCHEMBL19463296 0.76 GAA (0.59) GAAMEN1TSHRKMT2AALDH1A1

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 4 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-1192154-B1 BISPIDINE COMPOUNDS USEFUL IN THE TREATMENT OF CARDIAC ARRHYTHMIAS ASTRAZENECA AB (SE) 2004-03-17 EP disclosed
EP-1192154-A1 BISPIDINE COMPOUNDS USEFUL IN THE TREATMENT OF CARDIAC ARRHYTHMIAS AstraZeneca AB (SE) 2002-04-03 EP disclosed
WO-2000076999-A1 NEW BISPIDINE COMPOUNDS USEFUL IN THE TREATMENT OF CARDIAC ARRHYTHMIAS ASTRAZENECA AB (SE) 2000-12-21 WO disclosed