SCHEMBL11264041

SCHEMBL11264041

O=[N+]([O-])c1ccc2nc(S(=O)(=O)c3ccccc3)cnc2c1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AGTR1 P30556 1/20 0.60
HTT P42858 5/20 0.53
MAPT P10636 3/20 0.53
SMN1; SMN2 Q16637 2/20 0.53
LMNA P02545 1/20 0.53
POLB P06746 1/20 0.50
PKM P14618 1/20 0.50
KMT2A Q03164 5/20 0.49
RAB9A P51151 4/20 0.46
HSP90AA1 P07900 2/20 0.46
CXCR5 P32302 2/20 0.46
APLNR P35414 2/20 0.46
CCR6 P51684 2/20 0.46
MEN1 O00255 2/20 0.46
GFER P55789 1/20 0.46
ALDH1A1 P00352 2/20 0.44
GAA P10253 1/20 0.44
NPC1 O15118 3/20 0.44
CYP1A2 P05177 1/20 0.42
RIPK1 Q13546 1/20 0.41

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
SCHEMBL11263318 0.81 ALDH1A1 (0.44) HTTMAPTSMN1; SMN2KMT2ARAB9A
SCHEMBL27767382 0.78 HTT (0.76) AGTR1HTTMAPTSMN1; SMN2LMNA
SCHEMBL11275070 0.78 HTT (0.71) HTTMAPTSMN1; SMN2LMNAPOLB
SCHEMBL11276109 0.78 HTT (0.71) AGTR1HTTMAPTSMN1; SMN2LMNA
SCHEMBL12814738 0.75 NPC1 (0.71) MAPTSMN1; SMN2LMNAKMT2ARAB9A
SCHEMBL11273547 0.75 HTT (0.51) HTTMAPTSMN1; SMN2LMNAPOLB
SCHEMBL11280402 0.75 HTT (0.61) AGTR1HTTMAPTSMN1; SMN2LMNA
SCHEMBL11279295 0.72 HTT (0.71) HTTMAPTSMN1; SMN2LMNAPOLB
SCHEMBL3720824 0.72 ALDH1A1 (0.50) SMN1; SMN2POLBKMT2ARAB9AMEN1
Benzenesulfonamide SCHEMBL28134411 0.72 CA2 (0.54) MAPTSMN1; SMN2LMNAPKMKMT2A

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-0018493-B1 2-SULFONYL-QUINOXALINES, PROCESSES FOR THEIR PREPARATION AND THEIR USE AS MICROBICIDES BAYER AG (DE) 1982-12-01 EP disclosed
EP-0018493-A1 2-Sulfonyl-quinoxalines, processes for their preparation and their use as microbicides BAYER AG (DE) 1980-11-12 EP disclosed