SCHEMBL11273503

SCHEMBL11273503

CC(C)(C)S(=O)(=O)c1cnc2cc(Cl)ccc2n1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTT P42858 2/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
NPC1 O15118 1/20 0.45
RAB9A P51151 1/20 0.45
RXFP1 Q9HBX9 1/20 0.45
HRH4 Q9H3N8 2/20 0.43
KMT2A Q03164 3/20 0.38
MAPT P10636 2/20 0.38
CNR1 P21554 1/20 0.37
CNR2 P34972 1/20 0.37
ADORA3 P0DMS8 1/20 0.36
FGFR3 P22607 1/20 0.36
KDR P35968 1/20 0.36
ALPL P05186 3/20 0.36
PIK3CG P48736 1/20 0.36
ALDH1A1 P00352 3/20 0.36
MEN1 O00255 2/20 0.36
KDM4E B2RXH2 1/20 0.36
USP2 O75604 1/20 0.36
HSD17B10 Q99714 1/20 0.36

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
SCHEMBL11273237 0.83 HTT (0.49) HTTSMN1; SMN2NPC1RAB9ARXFP1
SCHEMBL11302866 0.80 HRH4 (0.47) HTTSMN1; SMN2HRH4KMT2AMAPT
SCHEMBL11271385 0.79 HTT (0.46) HTTSMN1; SMN2HRH4KMT2AMAPT
SCHEMBL11266871 0.78 HTT (0.59) HTTSMN1; SMN2HRH4KMT2AMAPT
SCHEMBL11263264 0.77 HTT (0.75) HTTSMN1; SMN2HRH4KMT2AMAPT
SCHEMBL11277793 0.77 HRH4 (0.44) HTTSMN1; SMN2HRH4KMT2AMAPT
SCHEMBL11263335 0.76 HTT (0.49) HTTSMN1; SMN2HRH4KMT2AMAPT
SCHEMBL11272645 0.75 HTT (0.43) HTTSMN1; SMN2HRH4KMT2AMAPT
SCHEMBL11275070 0.75 HTT (0.71) HTTSMN1; SMN2HRH4KMT2AMAPT
SCHEMBL11270011 0.74 HRH4 (0.42) HTTSMN1; SMN2NPC1HRH4KMT2A

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