SCHEMBL6432002

SCHEMBL6432002

CCc1cccc(NC2CCN(S(=O)(=O)c3ccc(CNC(=O)c4cccc([N+](=O)[O-])c4)s3)CC2)c1.O=C(NCc1ccc(S(=O)(=O)N2CCC(Nc3cccc4c3CCCC4)CC2)s1)c1cccc([N+](=O)[O-])c1

nearest known ligand 0.43

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.43
KMT2A Q03164 4/20 0.43
MAPT P10636 3/20 0.41
CCR2 P41597 1/20 0.37
G6PD P11413 1/20 0.37
SIRT2 Q8IXJ6 1/20 0.37
ALDH1A1 P00352 2/20 0.36
LMNA P02545 2/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
NCOA3 Q9Y6Q9 1/20 0.36
MAPK9 P45984 1/20 0.36
MAPK10 P53779 1/20 0.36
MAPK1 P28482 1/20 0.35
POLB P06746 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
SCHEMBL2419255 0.92 MEN1 (0.46) MEN1KMT2AMAPTCCR2G6PD
SCHEMBL2419389 0.92 KMT2A (0.50) MEN1KMT2AMAPTCCR2G6PD
SCHEMBL2419313 0.86 MEN1 (0.49) MEN1KMT2AMAPTCCR2G6PD
SCHEMBL2428331 0.85 KMT2A (0.51) MEN1KMT2ACCR2G6PDSIRT2
SCHEMBL4965488 0.85 MEN1 (0.42) MEN1KMT2AALDH1A1SMN1; SMN2MAPK9
SCHEMBL2421192 0.84 MEN1 (0.49) MEN1KMT2ACCR2G6PDSIRT2
SCHEMBL2423145 0.84 MEN1 (0.46) MEN1KMT2AMAPTCCR2G6PD
SCHEMBL2422148 0.83 KMT2A (0.50) MEN1KMT2AMAPTCCR2G6PD
SCHEMBL7439831 0.83 MEN1 (0.43) MEN1KMT2AMAPTCCR2G6PD
SCHEMBL2425516 0.83 MEN1 (0.54) MEN1KMT2ACCR2G6PDSIRT2

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
EP-1218374-B1 PHARMACEUTICALLY ACTIVE SULFONAMIDE DERIVATIVES APPLIED RESEARCH SYSTEMS (AN) 2005-11-16 EP disclosed