SCHEMBL16229751

SCHEMBL16229751

CN1C2C1C21Cc2ccc(CNS(=O)(=O)c3cn(C)cn3)cc2C1Cc1ccccc1

nearest known ligand 0.60

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
SLC6A9 P48067 10/20 0.60
LMNA P02545 1/20 0.56
KMT2A Q03164 5/20 0.52
GAA P10253 2/20 0.52
MEN1 O00255 2/20 0.52
KCNH2 Q12809 1/20 0.45
ALDH1A1 P00352 1/20 0.41
AKT1 P31749 1/20 0.40
SLC8A1 P32418 1/20 0.39

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
SCHEMBL16229779 0.92 KMT2A (0.51) SLC6A9LMNAKMT2AGAAMEN1
SCHEMBL16229801 0.91 SLC6A9 (0.51) SLC6A9LMNAKMT2AGAAMEN1
SCHEMBL16229796 0.91 SLC6A9 (0.51) SLC6A9LMNAKMT2AGAAMEN1
SCHEMBL16229786 0.89 SLC6A9 (0.51) SLC6A9LMNAKMT2AGAAMEN1
SCHEMBL16229758 0.87 LMNA (0.50) SLC6A9LMNAKMT2AGAAMEN1
SCHEMBL16229774 0.86 SLC6A9 (0.65) SLC6A9LMNAKMT2AGAAMEN1
SCHEMBL16784645 0.83 SLC6A9 (0.41) SLC6A9LMNAKMT2AMEN1ALDH1A1
SCHEMBL16229804 0.83 KMT2A (0.47) SLC6A9LMNAKMT2AGAAMEN1
SCHEMBL16229780 0.83 SLC6A9 (0.52) SLC6A9LMNAKMT2AGAAMEN1
SCHEMBL16229748 0.82 SLC6A9 (0.45) SLC6A9LMNAKMT2AGAAMEN1

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
US-9051280-B2 Tetraline and indane derivatives, pharmaceutical compositions containing them, and their use in therapy AbbVie Deutschland GmbH & Co. KG (DE) 2015-06-09 US disclosed
US-8883839-B2 Tetraline and indane derivatives, pharmaceutical compositions containing them, and their use in therapy ABBOTT LABORATORIES (US) 2014-11-11 US disclosed