SCHEMBL4999732

SCHEMBL4999732

CC1=Nc2c(S(=O)(=O)O)ccc(S(=O)(=O)O)c2C1(C)C.[KH].[KH]

nearest known ligand 0.35

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
AURKA O14965 1/20 0.31
AURKB Q96GD4 1/20 0.31
MYC P01106 1/20 0.30

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
SCHEMBL4014873 0.79 MEN1 (0.47) MEN1KMT2AAURKAAURKBMYC
SCHEMBL101082 0.79 MYC (0.36) MEN1KMT2AAURKAAURKBMYC
SCHEMBL14093805 0.78
SCHEMBL101050 0.77 MEN1 (0.49) MEN1KMT2AAURKAAURKBMYC
Potassium Ion SCHEMBL4999730 0.77 NR4A1 (0.33) MEN1KMT2A
SCHEMBL14958133 0.76 MEN1 (0.52) MEN1KMT2A
SCHEMBL10064492 0.74 MEN1 (0.43) MEN1KMT2A
SCHEMBL29329231 0.74 ALDH1A1 (0.41) MEN1KMT2A
SCHEMBL29331370 0.72 ALDH1A1 (0.31) MEN1KMT2A
SCHEMBL4885961 0.70 TTR (0.43) MEN1KMT2AAURKAAURKBMYC

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-7411068-B2 Luminescent compounds SETA BIOMEDICALS, LLC 2008-08-12 US disclosed
US-20050202565-A1 Luminescent compounds SETA BIOMEDICALS, LLC 2005-09-15 US disclosed