SCHEMBL6563639

SCHEMBL6563639

Cc1oncc1C(=O)Nc1ccccc1NS(=O)(=O)c1ccc([N+](=O)[O-])cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 5/20 0.47
KMT2A Q03164 5/20 0.47
LMNA P02545 3/20 0.47
SMN1; SMN2 Q16637 3/20 0.47
MAPT P10636 2/20 0.47
SLC5A1 P13866 1/20 0.47
HTT P42858 1/20 0.47
NCOA1 Q15788 1/20 0.47
NCOA3 Q9Y6Q9 1/20 0.47
TDP1 Q9NUW8 2/20 0.46
TSHR P16473 1/20 0.46
EDNRB P24530 2/20 0.45
EDNRA P25101 2/20 0.45
NPC1 O15118 1/20 0.45
RAB9A P51151 1/20 0.45
CSF1R P07333 1/20 0.45
KDM4E B2RXH2 1/20 0.44
ALDH1A1 P00352 1/20 0.44
CYP3A4 P08684 1/20 0.44
HPGD P15428 1/20 0.44

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
SCHEMBL6562125 0.88 LMNA (0.60) MEN1KMT2ALMNASMN1; SMN2MAPT
SCHEMBL6561793 0.88 RAB9A (0.51) MEN1KMT2ALMNASMN1; SMN2HTT
SCHEMBL6563618 0.86 ALDH1A1 (0.53) MEN1KMT2ALMNASMN1; SMN2MAPT
SCHEMBL6561650 0.84 KEAP1 (0.53) MEN1KMT2ALMNASMN1; SMN2MAPT
SCHEMBL6562093 0.80 SMN1; SMN2 (0.54) MEN1KMT2ALMNASMN1; SMN2MAPT
SCHEMBL9564642 0.78 RAB9A (0.62) MEN1KMT2ALMNASMN1; SMN2MAPT
SCHEMBL19402543 0.77 KMT2A (0.67) MEN1KMT2ALMNASMN1; SMN2MAPT
SCHEMBL19376893 0.77 RAB9A (0.59) MEN1KMT2ALMNASMN1; SMN2MAPT
SCHEMBL18341046 0.74 KDM4E (0.63) MEN1KMT2ALMNASMN1; SMN2MAPT
SCHEMBL21987781 0.73 LMNA (0.61) MEN1KMT2ALMNASMN1; SMN2MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0990645-B1 NOVEL SULFONAMIDE DERIVATIVES NIPPON KAYAKU KK (JP) 2004-07-28 EP disclosed
US-6180796-B1 TUBULIN POLYMERIZATION INHIBITORS NIPPON KAYAKU KABUSHIKI KAISHA (JP) 2001-01-30 US disclosed
EP-0990645-A1 NOVEL SULFONAMIDE DERIVATIVES Nippon Kayaku Kabushiki Kaisha (JP) 2000-04-05 EP disclosed