SCHEMBL12469010

SCHEMBL12469010

COC(=O)c1ccc(-c2nc(CS(=O)(=O)C3CCNCC3)c(C)o2)cc1

nearest known ligand 0.49

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 6/20 0.49
MEN1 O00255 5/20 0.49
HRH1 P35367 1/20 0.48
HSD17B10 Q99714 3/20 0.46
KDM4E B2RXH2 2/20 0.46
HTT P42858 1/20 0.46
USP2 O75604 1/20 0.45
ALOX15 P16050 1/20 0.45
POLB P06746 3/20 0.45
MAPT P10636 1/20 0.45
TP53 P04637 1/20 0.43

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
SCHEMBL12468954 0.90 KMT2A (0.55) KMT2AMEN1HRH1HSD17B10KDM4E
SCHEMBL15323391 0.82 KMT2A (0.49) KMT2AMEN1HRH1HSD17B10KDM4E
SCHEMBL12469068 0.81 KMT2A (0.47) KMT2AMEN1HRH1HSD17B10KDM4E
SCHEMBL12469663 0.81 KMT2A (0.50) KMT2AMEN1HRH1HSD17B10USP2
SCHEMBL15325934 0.81 KMT2A (0.47) KMT2AMEN1HRH1HSD17B10KDM4E
SCHEMBL15325984 0.81 KMT2A (0.47) KMT2AMEN1HRH1HSD17B10KDM4E
SCHEMBL12468887 0.79 MAPT (0.58) KMT2AMEN1KDM4EHTTUSP2
SCHEMBL15419485 0.78 KMT2A (0.44) KMT2AMEN1HRH1HSD17B10KDM4E
SCHEMBL15419606 0.78 KMT2A (0.44) KMT2AMEN1HRH1HSD17B10KDM4E
SCHEMBL12469078 0.78 MAPT (0.70) KMT2AMEN1HSD17B10KDM4EHTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2838534-A2 SUBSTITUTED BENZAMIDES AND THEIR USES The Board of Trustees of The Leland Stanford Junior University (US) 2015-02-25 EP disclosed
WO-2013155338-A2 SUBSTITUTED BENZAMIDES AND THEIR USES THE BOARD OF TRUSTEES OF THE LELAND STANFORD JUNIOR UNIVERSITY (US) 2013-10-17 WO disclosed
EP-2627324-A2 SUBSTITUTED BENZAMIDES AND THEIR USES The Board of Trustees of The Leland Stanford Junior University (US) 2013-08-21 EP disclosed
WO-2012051117-A2 SUBSTITUTED BENZAMIDES AND THEIR USES THE BOARD OF TRUSTEES OF THE LELAND STANFORD JUNIOR UNIVERSITY (US) 2012-04-19 WO disclosed