SCHEMBL8715864

SCHEMBL8715864

COc1cccc(S(=O)(=O)c2ccccc2)c1OC

nearest known ligand 0.74

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 7/20 0.74
EGFR P00533 1/20 0.45
KDM4E B2RXH2 2/20 0.45
USP2 O75604 1/20 0.45
GAA P10253 1/20 0.45
HPGD P15428 1/20 0.45
HSD17B10 Q99714 1/20 0.45
TP53 P04637 1/20 0.43
RXFP1 Q9HBX9 1/20 0.43
NFE2L2 Q16236 1/20 0.42
MMP2 P08253 1/20 0.42
MMP8 P22894 1/20 0.42
MMP12 P39900 1/20 0.42
MMP13 P45452 1/20 0.42
MMP14 P50281 1/20 0.42
MMP16 P51512 1/20 0.42
PKM P14618 1/20 0.42
FEN1 P39748 1/20 0.42
ABCC9 O60706 1/20 0.42
ABCC8 Q09428 1/20 0.42

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
SCHEMBL6912891 0.87 HTR6 (0.53) HTR6NFE2L2KMT2A
SCHEMBL6913555 0.85 HTR6 (1.00) HTR6KDM4ETP53RXFP1MMP2
SCHEMBL7896731 0.85 HTR6 (0.57) HTR6EGFRGAANFE2L2MEN1
SCHEMBL27950989 0.82 HTR6 (0.50) HTR6GAANFE2L2ABCC9ABCC8
SCHEMBL17472499 0.81 HTR6 (0.72) HTR6KDM4ETP53RXFP1MMP2
SCHEMBL16494447 0.80 HTR6 (0.70) HTR6EGFRKDM4ETP53RXFP1
SCHEMBL3166338 0.79 NFE2L2 (0.59) HTR6NFE2L2
SCHEMBL3166330 0.79 NFE2L2 (0.59) HTR6NFE2L2
SCHEMBL14062243 0.79 HTR6 (0.58) HTR6KDM4EGAAMMP2MMP8
SCHEMBL9252637 0.78 SMN1; SMN2 (0.47) HTR6NFE2L2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-103588720-B Benzo [the synthetic method of c] isoxazole-3 (1H)-one HEBEI UNIVERSITY OF SCIENCE AND TECHNOLOGY (CN) 2016-04-06 CN disclosed
CN-103588720-A Synthesis method of benzo [c] isoxazole-3(1H)-ketone UNIV HEBEI SCIENCE & TECH 2014-02-19 CN disclosed
EP-0860429-A1 DIPHENYL SULFONE CROSSLINKING TYPE COMPOUNDS AND RECORDING MATERIALS USING THEM NIPPON SODA CO., LTD. (JP) 1998-08-26 EP disclosed