SCHEMBL7396756

SCHEMBL7396756

NC(=O)c1cccc(NC2CCN(S(=O)(=O)c3ccc(CNC(=O)c4ccc([N+](=O)[O-])cc4)s3)CC2)c1.O=C(NCc1ccc(S(=O)(=O)N2CCC(Nc3cccc([N+](=O)[O-])c3)CC2)s1)c1ccc([N+](=O)[O-])cc1

nearest known ligand 0.48

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 5/20 0.48
MEN1 O00255 4/20 0.48
MAPK9 P45984 1/20 0.45
MAPK10 P53779 1/20 0.45
MAPT P10636 1/20 0.41
SIRT2 Q8IXJ6 1/20 0.40
POLB P06746 1/20 0.40
TDP1 Q9NUW8 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
THRB P10828 1/20 0.39
ALDH1A1 P00352 2/20 0.38
G6PD P11413 1/20 0.37
LMNA P02545 1/20 0.37
MAPK1 P28482 1/20 0.37
GAA P10253 1/20 0.37

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
SCHEMBL2421181 0.98 MEN1 (0.49) KMT2AMEN1MAPK9MAPK10MAPT
SCHEMBL2424613 0.95 MEN1 (0.47) KMT2AMEN1MAPK9MAPK10SIRT2
SCHEMBL2427809 0.95 KMT2A (0.50) KMT2AMEN1MAPK9MAPK10MAPT
SCHEMBL2426958 0.92 MEN1 (0.48) KMT2AMEN1MAPK9MAPK10MAPT
SCHEMBL6432690 0.91 MEN1 (0.52) KMT2AMEN1MAPK9MAPK10MAPT
SCHEMBL2428331 0.91 KMT2A (0.51) KMT2AMEN1MAPK9MAPK10SIRT2
SCHEMBL2421919 0.90 MEN1 (0.47) KMT2AMEN1MAPK9MAPK10MAPT
SCHEMBL4199494 0.90 MEN1 (0.50) KMT2AMEN1MAPK9MAPK10MAPT
SCHEMBL2421220 0.89 MAPK9 (0.54) KMT2AMEN1MAPK9MAPK10MAPT
SCHEMBL2419812 0.89 MEN1 (0.49) KMT2AMEN1MAPK9MAPK10MAPT

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
EP-1218374-A1 PHARMACEUTICALLY ACTIVE SULFONAMIDE DERIVATIVES Applied Research Systems ARS Holding N.V. (AN) 2002-07-03 EP claimed
WO-2001023378-A1 PHARMACEUTICALLY ACTIVE SULFONAMIDE DERIVATIVES APPLIED RESEARCH SYSTEMS ARS HOLDING N.V. (AN) 2001-04-05 WO claimed