SCHEMBL7437261

SCHEMBL7437261

CCCc1cccc(OC2CCN(S(=O)(=O)c3ccc(CNC(=O)c4cccc([N+](=O)[O-])c4)s3)CC2)c1.O=C(NCc1ccc(S(=O)(=O)N2CCC(Nc3ncccn3)CC2)s1)c1ccc([N+](=O)[O-])cc1

nearest known ligand 0.43

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.43
KMT2A Q03164 4/20 0.43
NPC1 O15118 2/20 0.38
RAB9A P51151 2/20 0.38
MAPK9 P45984 1/20 0.37
MAPK10 P53779 1/20 0.37
PABPC1 P11940 1/20 0.37
SLC5A7 Q9GZV3 1/20 0.37
CYP1A2 P05177 1/20 0.37
CYP3A4 P08684 1/20 0.37
FFAR1 O14842 1/20 0.36
USP5 P45974 1/20 0.36
ALDH1A1 P00352 3/20 0.36
GAA P10253 1/20 0.36
PKM P14618 1/20 0.36
LMNA P02545 1/20 0.35
MAPT P10636 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
SCHEMBL2421323 0.90 KMT2A (0.50) MEN1KMT2ANPC1RAB9ASLC5A7
SCHEMBL2425264 0.90 MEN1 (0.51) MEN1KMT2ANPC1RAB9AMAPK9
SCHEMBL4965488 0.89 MEN1 (0.42) MEN1KMT2ANPC1RAB9AMAPK9
SCHEMBL4197508 0.86 MAPT (0.34) MEN1KMT2AALDH1A1GAALMNA
SCHEMBL2422166 0.86 CYP1A2 (0.49) MEN1KMT2AMAPK9MAPK10CYP1A2
SCHEMBL6021869 0.85 MAPK1 (0.42) MEN1KMT2ANPC1ALDH1A1GAA
SCHEMBL2422967 0.83 MEN1 (0.51) MEN1KMT2AMAPK9MAPK10ALDH1A1
SCHEMBL2419313 0.83 MEN1 (0.49) MEN1KMT2AMAPK9MAPK10ALDH1A1
SCHEMBL2422241 0.82 MEN1 (0.49) MEN1KMT2AMAPK9MAPK10FFAR1
SCHEMBL2425351 0.81 MEN1 (0.49) MEN1KMT2AMAPK9MAPK10ALDH1A1

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