SCHEMBL11280423

SCHEMBL11280423

O=S(=O)(c1ccc(Br)cc1)c1cnc2cc(Cl)ccc2n1

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTT P42858 5/20 0.68
MAPT P10636 2/20 0.68
LMNA P02545 1/20 0.68
SMN1; SMN2 Q16637 2/20 0.63
PKM P14618 2/20 0.46
POLB P06746 1/20 0.46
KMT2A Q03164 2/20 0.45
HRH4 Q9H3N8 2/20 0.40
KDM4E B2RXH2 2/20 0.40
CCR2 P41597 2/20 0.39
GRM5 P41594 1/20 0.39
AKR1B1 P15121 1/20 0.38
ALDH1A1 P00352 2/20 0.37
MEN1 O00255 1/20 0.37
RXFP1 Q9HBX9 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
CYP3A4 P08684 1/20 0.37
MAPK1 P28482 1/20 0.37
FLT1 P17948 1/20 0.36
FLT4 P35916 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
SCHEMBL11263264 0.91 HTT (0.75) HTTMAPTLMNASMN1; SMN2PKM
SCHEMBL11275070 0.86 HTT (0.71) HTTMAPTLMNASMN1; SMN2PKM
SCHEMBL11482857 0.83 HTT (0.59) HTTMAPTLMNASMN1; SMN2PKM
SCHEMBL11275574 0.83 HTT (0.70) HTTMAPTLMNASMN1; SMN2PKM
SCHEMBL11266871 0.83 HTT (0.59) HTTMAPTLMNASMN1; SMN2PKM
SCHEMBL11279295 0.80 HTT (0.71) HTTMAPTLMNASMN1; SMN2PKM
SCHEMBL11276109 0.80 HTT (0.71) HTTMAPTLMNASMN1; SMN2PKM
SCHEMBL11273237 0.76 HTT (0.49) HTTMAPTLMNASMN1; SMN2PKM
SCHEMBL11302866 0.74 HRH4 (0.47) HTTMAPTLMNASMN1; SMN2PKM
SCHEMBL11271385 0.72 HTT (0.46) HTTMAPTLMNASMN1; SMN2PKM

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