SCHEMBL7520267

SCHEMBL7520267

O=S(O)c1ccccc1Br.[NaH]

nearest known ligand 0.39

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
G6PD P11413 1/20 0.39
GAA P10253 1/20 0.37
ALDH1A1 P00352 3/20 0.33
CA1 P00915 1/20 0.33
CA2 P00918 1/20 0.33
CA4 P22748 1/20 0.33
CA6 P23280 1/20 0.33
HSD11B1 P28845 1/20 0.33
PLCG1 P19174 1/20 0.31
MAPK1 P28482 1/20 0.31
TDP1 Q9NUW8 1/20 0.31
MEN1 O00255 1/20 0.31
NPC1 O15118 1/20 0.31
LMNA P02545 1/20 0.31
HTT P42858 1/20 0.31
RAB9A P51151 1/20 0.31
KMT2A Q03164 1/20 0.31
MGLL Q99685 1/20 0.30

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
SCHEMBL499420 0.98 G6PD (0.41) G6PDGAAALDH1A1CA1CA2
SCHEMBL27579679 0.95 G6PD (0.39) G6PDGAAALDH1A1CA1CA2
SCHEMBL27597438 0.95 G6PD (0.39) G6PDGAAALDH1A1CA1CA2
SCHEMBL11859134 0.82 G6PD (0.48) G6PDALDH1A1CA2CA4TDP1
SCHEMBL9153083 0.79 G6PD (0.50) G6PDALDH1A1CA1CA2CA4
SCHEMBL11423411 0.79 PARP1 (0.40) G6PDGAAMEN1KMT2A
SCHEMBL10670811 0.73 ALOX15 (0.43) ALDH1A1CA1CA2CA4MAPK1
SCHEMBL9151925 0.72 G6PD (0.44) G6PDALDH1A1CA1CA2PLCG1
SCHEMBL7515346 0.71 G6PD (0.39) G6PDALDH1A1TDP1MEN1KMT2A
SCHEMBL7520260 0.71 G6PD (0.34) G6PDGAAALDH1A1CA1CA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-106543051-A A kind of preparation method of Aromatic Sulfide class compound 南京理工大学 2017-03-29 CN claimed
CN-103922976-A Asymmetric diaryl sulfone compound and preparation method thereof UNIV SHAOXING 2014-07-16 CN claimed
CN-106543051-B A kind of preparation method of Aromatic Sulfide class compound 南京理工大学 2018-10-02 CN disclosed
CN-105906537-B (Z)The One-step Synthesis method of formula sulfonyl enoic acid ester compounds 湖南科技学院 2017-12-15 CN disclosed
CN-106543051-A A kind of preparation method of Aromatic Sulfide class compound 南京理工大学 2017-03-29 CN disclosed
CN-105906537-A One-pot synthesis method of (Z)-type sulfonyl olefine acid ester compound 湖南科技学院 2016-08-31 CN disclosed
CN-103922976-A Asymmetric diaryl sulfone compound and preparation method thereof UNIV SHAOXING 2014-07-16 CN disclosed
CN-1464876-A Novel sulfone derivative and process for producing the same SUMITOMO CHEMICAL CO (JP) 2003-12-31 CN disclosed
CN-1373112-A Method for producing allyl halide SUMITOMO CHEMICAL CO (JP) 2002-10-09 CN disclosed
EP-1231197-A1 Process for producing allyl halide compound SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2002-08-14 EP disclosed
US-20020107422-A1 Process for producing allyl halide compound SUMITOMO CHEMICAL COMPANY LIMITED (JP) 2002-08-08 US disclosed
US-5153227-A Treatment of diabetes and galactosemia complications IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1992-10-06 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20020107422-A1 Process for producing allyl halide compound ENY2, ZYX, RPS4Y1 G6PD 3142/4885GAA 4057/4885ALDH1A1 1133/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.