SCHEMBL28670313

SCHEMBL28670313

NC(=O)c1ccc(C(N)=O)c(S(=O)(=O)c2ccccc2)c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 3/20 0.47
ALDH1A1 P00352 2/20 0.47
KDM4E B2RXH2 1/20 0.47
PKM P14618 1/20 0.47
HPGD P15428 1/20 0.47
HTR6 P50406 2/20 0.43
POLB P06746 2/20 0.42
GFER P55789 1/20 0.42
CYP3A4 P08684 1/20 0.42
PARP1 P09874 1/20 0.42
MAPT P10636 1/20 0.42
TSHR P16473 1/20 0.42
CYP2C19 P33261 1/20 0.42
RECQL P46063 1/20 0.42
BLM P54132 1/20 0.42
PMP22 Q01453 1/20 0.42
HSD17B10 Q99714 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
HTR2A P28223 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
SCHEMBL25439720 0.91 ACLY (0.49) ACLYCA2IKBKB
SCHEMBL364480 0.81 HTR6 (0.55) GAAALDH1A1KDM4EHPGDHTR6
SCHEMBL11638000 0.80 KDM4E (0.50) GAAALDH1A1KDM4EPKMHPGD
(Phenylsulfonyl)Benzene SCHEMBL1736247 0.79 MAPT (0.62) GAAALDH1A1KDM4EHPGDHTR6
SCHEMBL359496 0.78 CA2 (0.42) PARP1TSHRACLYCA2MAPK1
SCHEMBL2970077 0.77 CA2 (0.61) GAAALDH1A1KDM4EHPGDHTR6
SCHEMBL16990464 0.76 SLC9A1 (0.44) PARP1CA2MAPK1SMN1; SMN2
SCHEMBL2850632 0.76 GAA (0.58) GAAALDH1A1HPGDHTR6POLB
SCHEMBL28698421 0.75 HTR6 (0.50) ALDH1A1KDM4EHPGDHTR6POLB
SCHEMBL10582655 0.75 ALDH1A1 (0.49) GAAALDH1A1KDM4EPKMHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110461157-B Herbicidal mixtures 拜耳公司 2021-11-02 CN disclosed