SCHEMBL7902113

SCHEMBL7902113

COc1ccc(C=CS(=O)(=O)c2ccccc2)cc1

nearest known ligand 0.68

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
NFE2L2 Q16236 11/20 0.68
EGFR P00533 1/20 0.63
PPARG P37231 1/20 0.62
TRPA1 O75762 1/20 0.59
ALDH1A1 P00352 1/20 0.57
LMNA P02545 1/20 0.57
SNCA P37840 1/20 0.55
GAA P10253 1/20 0.50
MAPT P10636 1/20 0.50
PTGES2 Q9H7Z7 1/20 0.50
BCHE P06276 1/20 0.50
CYP3A4 P08684 1/20 0.50
NFKB1 P19838 1/20 0.50
NFKB2 Q00653 1/20 0.50
RELA Q04206 1/20 0.50

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
SCHEMBL7902110 1.00 NFE2L2 (0.68) NFE2L2EGFRPPARGTRPA1ALDH1A1
SCHEMBL7904281 0.93 NFE2L2 (0.72) NFE2L2EGFRPPARGTRPA1ALDH1A1
SCHEMBL7904278 0.93 NFE2L2 (0.72) NFE2L2EGFRPPARGTRPA1ALDH1A1
SCHEMBL28341391 0.91 NFE2L2 (0.79) NFE2L2EGFRPPARGALDH1A1LMNA
SCHEMBL28341395 0.85 NFE2L2 (0.70) NFE2L2PPARGALDH1A1RELA
SCHEMBL28341396 0.85 NFE2L2 (0.70) NFE2L2PPARGALDH1A1RELA
SCHEMBL1194740 0.84 NFE2L2 (0.68) NFE2L2ALDH1A1LMNAMAPTCYP3A4
SCHEMBL1194737 0.84 NFE2L2 (0.68) NFE2L2ALDH1A1LMNAMAPTCYP3A4
SCHEMBL7896106 0.83 RELA (0.63) NFE2L2EGFRMAPTRELA
SCHEMBL7896104 0.83 RELA (0.63) NFE2L2EGFRMAPTRELA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116332900-B Olefin compound and synthesis method thereof 华中科技大学 2024-12-06 CN claimed
CN-116332900-A Olefin compound and synthesis method thereof 华中科技大学 2023-06-27 CN claimed
CN-116332900-B Olefin compound and synthesis method thereof 华中科技大学 2024-12-06 CN disclosed
CN-117430125-A Preparation method and application of manganese doped mesoporous structure-containing acidic Beta zeolite molecular sieve 常州大学 2024-01-23 CN disclosed
CN-116332900-A Olefin compound and synthesis method thereof 华中科技大学 2023-06-27 CN disclosed
CN-108623503-B Green preparation method of vinyl sulfone derivative in water phase 宁波大学 2020-01-03 CN disclosed
US-6201131-B1 REACTING A 2-(ARYLSUFONYL) ETHANOL DERIVATIVE WITH AN ACID ANHYDRIDE IN PRESENCE OF A BASE, FURTHER REACTING THIS WITH AN AROMATIC HALIDE IN THE PRESENCE OF A PALLADIUM CATALYST; USEFUL AS INTERMEDIATES TO DRUGS, AGROCHEMICALS SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2001-03-13 US disclosed