SCHEMBL13827329

SCHEMBL13827329

Cn1cnc(S(=O)(=O)NCc2ccc3c(c2)C(Cc2ccccc2)NCCC3)c1

nearest known ligand 0.67

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
SLC6A9 P48067 12/20 0.67
LMNA P02545 1/20 0.56
KCNH2 Q12809 1/20 0.51
KMT2A Q03164 4/20 0.49
GAA P10253 2/20 0.49
MEN1 O00255 1/20 0.49
ALDH1A1 P00352 1/20 0.41
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
SCHEMBL13827337 0.92 SLC6A9 (0.57) SLC6A9LMNAKCNH2KMT2AGAA
SCHEMBL13827792 0.92 SLC6A9 (0.57) SLC6A9LMNAKCNH2KMT2AGAA
SCHEMBL17675751 0.91 SLC6A9 (0.56) SLC6A9LMNAKCNH2KMT2AGAA
SCHEMBL13738539 0.89 SLC6A9 (0.64) SLC6A9LMNAKCNH2KMT2AGAA
SCHEMBL13827334 0.87 SLC6A9 (0.51) SLC6A9LMNAKCNH2KMT2AGAA
SCHEMBL13737074 0.86 SLC6A9 (0.69) SLC6A9LMNAKCNH2KMT2AGAA
SCHEMBL17675708 0.84 MEN1 (0.57) SLC6A9LMNAKCNH2KMT2AMEN1
SCHEMBL13827486 0.83 SLC6A9 (0.71) SLC6A9LMNAKCNH2KMT2AGAA
SCHEMBL13827404 0.83 SLC6A9 (0.47) SLC6A9KMT2AGAAMEN1ALDH1A1
SCHEMBL17675709 0.83 SLC6A9 (0.47) SLC6A9KCNH2KMT2AMEN1

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9309200-B2 Benzazepine derivatives, pharmaceutical compositions containing them, and their use in therapy AbbVie Deutschland GmbH & Co. KG (DE) 2016-04-12 US disclosed
US-9309200-B2 Benzazepine derivatives, pharmaceutical compositions containing them, and their use in therapy AbbVie Deutschland GmbH & Co. KG (DE) 2016-04-12 US disclosed
WO-2012152915-A1 BENZAZEPINE DERIVATIVES, PHARMACEUTICAL COMPOSITIONS CONTAINING THEM, AND THEIR USE IN THERAPY ABBOTT GMBH & CO. KG (DE) 2012-11-15 WO disclosed