SCHEMBL16229779

SCHEMBL16229779

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

nearest known ligand 0.51

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 5/20 0.51
SLC6A9 P48067 13/20 0.51
KCNH2 Q12809 1/20 0.48
LMNA P02545 1/20 0.47
MEN1 O00255 2/20 0.42
GAA P10253 1/20 0.42

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
SCHEMBL16229751 0.92 SLC6A9 (0.60) KMT2ASLC6A9KCNH2LMNAMEN1
SCHEMBL16229804 0.91 KMT2A (0.47) KMT2ASLC6A9KCNH2LMNAMEN1
SCHEMBL16229780 0.91 SLC6A9 (0.52) KMT2ASLC6A9KCNH2LMNAMEN1
SCHEMBL16229797 0.89 SLC6A9 (0.53) KMT2ASLC6A9KCNH2LMNAMEN1
SCHEMBL16229774 0.88 SLC6A9 (0.65) KMT2ASLC6A9KCNH2LMNAMEN1
SCHEMBL16229748 0.87 SLC6A9 (0.45) KMT2ASLC6A9KCNH2LMNAMEN1
SCHEMBL16229746 0.84 HTT (0.40) SLC6A9LMNAGAA
SCHEMBL16229796 0.83 SLC6A9 (0.51) KMT2ASLC6A9KCNH2LMNAMEN1
SCHEMBL16229801 0.83 SLC6A9 (0.51) KMT2ASLC6A9KCNH2LMNAMEN1
SCHEMBL16229777 0.83 SLC6A9 (0.51) KMT2ASLC6A9KCNH2LMNAMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8883839-B2 Tetraline and indane derivatives, pharmaceutical compositions containing them, and their use in therapy ABBOTT LABORATORIES (US) 2014-11-11 US disclosed