SCHEMBL8310433

SCHEMBL8310433

N#Cc1nc(-c2ccccc2)c(Cl)n1S(=O)(=O)N1CCOCC1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTT P42858 2/20 0.43
GAA P10253 3/20 0.42
TSHR P16473 3/20 0.42
MAPK1 P28482 3/20 0.42
KDM4E B2RXH2 5/20 0.42
ADORA2A P29274 1/20 0.41
MEN1 O00255 3/20 0.41
KMT2A Q03164 3/20 0.41
POLB P06746 1/20 0.41
LMNA P02545 4/20 0.38
HSD17B10 Q99714 2/20 0.37
MAPT P10636 2/20 0.37
NPSR1 Q6W5P4 1/20 0.37
CASP1 P29466 1/20 0.37
GRM5 P41594 1/20 0.37
PKM P14618 1/20 0.37
CYP1A2 P05177 1/20 0.37
CCNA2 P20248 1/20 0.37
CDK2 P24941 1/20 0.37
ALDH1A1 P00352 5/20 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
SCHEMBL6959749 0.84 HTT (0.45) HTTGAATSHRMAPK1KDM4E
SCHEMBL9323989 0.74 TSHR (0.49) HTTTSHRMAPK1KDM4EADORA2A
SCHEMBL8309018 0.71 MAPT (0.43) HTTTSHRMAPK1KDM4EADORA2A
SCHEMBL13431733 0.62 HTT (0.57) HTTGAATSHRMAPK1MEN1
SCHEMBL933331 0.61 TSHR (0.34) TSHRKMT2ALMNAMAPTHPGD
SCHEMBL14247595 0.61 TSHR (0.64) HTTGAATSHRMAPK1MEN1
SCHEMBL20022000 0.59 KMT2A (1.00) GAATSHRMAPK1KDM4EMEN1
SCHEMBL8430909 0.59 TSHR (0.49) HTTTSHRMAPK1KDM4EMEN1
SCHEMBL28685916 0.59 GAA (0.67) GAATSHRKDM4EMEN1KMT2A
SCHEMBL6954775 0.59 ADORA2A (0.33) HTTTSHRKDM4EADORA2AMEN1

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-0906311-A1 N-SULFONYLIMIDAZOLES USED AS FUNGICIDES BAYER AG (DE) 1999-04-07 EP disclosed
WO-1997047620-A1 N-SULFONYLIMIDAZOLES USED AS FUNGICIDES BAYER AKTIENGESELLSCHAFT (DE) 1997-12-18 WO disclosed