SCHEMBL16229804

SCHEMBL16229804

CN1C2C1C21Cc2ccc(CCNS(=O)(=O)c3cn(C)cn3)cc2C1Cc1cccc(F)c1

nearest known ligand 0.47

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.47
SLC6A9 P48067 12/20 0.42
GAA P10253 2/20 0.41
MEN1 O00255 1/20 0.41
KCNH2 Q12809 1/20 0.40
LMNA P02545 1/20 0.39
DGAT1 O75907 1/20 0.37
MGAT3 Q09327 1/20 0.37
MGAT2 Q10469 1/20 0.37
ALDH1A1 P00352 1/20 0.35

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
SCHEMBL16229801 0.92 SLC6A9 (0.51) KMT2ASLC6A9GAAMEN1KCNH2
SCHEMBL16229779 0.91 KMT2A (0.51) KMT2ASLC6A9GAAMEN1KCNH2
SCHEMBL16229780 0.91 SLC6A9 (0.52) KMT2ASLC6A9GAAMEN1KCNH2
SCHEMBL16229797 0.90 SLC6A9 (0.53) KMT2ASLC6A9GAAMEN1KCNH2
SCHEMBL16229788 0.89 KMT2A (0.41) KMT2ASLC6A9GAAMEN1KCNH2
SCHEMBL16229749 0.89 SLC6A9 (0.55) KMT2ASLC6A9GAAMEN1KCNH2
SCHEMBL16229789 0.85 DGAT1 (0.40) KMT2ASLC6A9LMNADGAT1MGAT3
SCHEMBL16229773 0.85 SLC6A9 (0.45) KMT2ASLC6A9GAAMEN1KCNH2
SCHEMBL16229760 0.85 KMT2A (0.45) KMT2ASLC6A9GAAMEN1KCNH2
SCHEMBL16229751 0.83 SLC6A9 (0.60) KMT2ASLC6A9GAAMEN1KCNH2

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