SCHEMBL1648035

SCHEMBL1648035

COc1c(-c2cnsc2)ccc(CS(=O)(=O)c2ccccc2)c1C(=O)O

nearest known ligand 0.38

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KEAP1 Q14145 5/20 0.38
NFE2L2 Q16236 2/20 0.38
METAP2 P50579 3/20 0.36
ALOX5AP P20292 1/20 0.36
HSD11B1 P28845 2/20 0.36
KMT2A Q03164 1/20 0.35
ALDH1A1 P00352 3/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
NPC1 O15118 2/20 0.33
RAB9A P51151 2/20 0.33
SMN1; SMN2 Q16637 2/20 0.33
MAPT P10636 2/20 0.33
MAPK1 P28482 1/20 0.33
PTGDR2 Q9Y5Y4 1/20 0.32
TP53 P04637 1/20 0.32
GLA P06280 1/20 0.32

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
SCHEMBL1648095 0.92 KEAP1 (0.37) KEAP1NFE2L2METAP2ALOX5APHSD11B1
SCHEMBL1647754 0.85 KMT2A (0.43) KEAP1NFE2L2METAP2ALOX5APHSD11B1
SCHEMBL6844856 0.83 HSD11B1 (0.40) KEAP1NFE2L2HSD11B1KMT2AALDH1A1
SCHEMBL1648227 0.83 PTGS2 (0.40) METAP2ALOX5APHSD11B1KMT2AALDH1A1
SCHEMBL1647756 0.81 METAP2 (0.53) KEAP1NFE2L2METAP2HSD11B1KMT2A
SCHEMBL1648425 0.81 KMT2A (0.36) KEAP1NFE2L2METAP2ALOX5APHSD11B1
SCHEMBL1648189 0.80 ALOX5AP (0.36) KEAP1NFE2L2METAP2ALOX5APHSD11B1
SCHEMBL18801286 0.80 SLC37A4 (0.37) KMT2AALDH1A1L3MBTL1NPC1RAB9A
SCHEMBL1647713 0.78 ERN1 (0.39) KEAP1NFE2L2HSD11B1KMT2AALDH1A1
SCHEMBL1648368 0.77 IMPDH2 (0.43)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2486004-B1 SULPHONE COMPOUNDS FOR USE IN THE TREATMENT OF OBESITY ZAFGEN INC (US) 2017-05-03 EP disclosed
EP-2486004-B1 SULPHONE COMPOUNDS FOR USE IN THE TREATMENT OF OBESITY ZAFGEN INC (US) 2017-05-03 EP disclosed
US-20160051531-A1 SULPHONE COMPOUNDS AND METHODS OF MAKING AND USING SAME ZAFGEN INC (US) 2016-02-25 US disclosed
US-9067905-B2 Sulphone compounds and methods of making and using same ZAFGEN, INC. (US) 2015-06-30 US disclosed
US-9067905-B2 Sulphone compounds and methods of making and using same ZAFGEN, INC. (US) 2015-06-30 US disclosed
US-9067905-B2 Sulphone compounds and methods of making and using same ZAFGEN, INC. (US) 2015-06-30 US disclosed
US-20130053364-A1 Sulphone Compounds and Methods of Making and Using Same ZAFGEN, INC. 2013-02-28 US disclosed
US-20130053364-A1 Sulphone Compounds and Methods of Making and Using Same ZAFGEN, INC. 2013-02-28 US disclosed
US-20130053364-A1 Sulphone Compounds and Methods of Making and Using Same ZAFGEN, INC. 2013-02-28 US disclosed
EP-2486004-A2 SULPHONE COMPOUNDS AND METHODS OF MAKING AND USING SAME Zafgen Corporation (US) 2012-08-15 EP disclosed
CN-102639494-A Sulphone compounds and methods of making and using same ZAFGEN CORP 2012-08-15 CN disclosed
WO-2011044506-A2 SULPHONE COMPOUNDS AND METHODS OF MAKING AND USING SAME ZAFGEN CORPORATION (US) 2011-04-14 WO disclosed
WO-2011044506-A2 SULPHONE COMPOUNDS AND METHODS OF MAKING AND USING SAME ZAFGEN CORPORATION (US) 2011-04-14 WO 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 (2 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-20160051531-A1 SULPHONE COMPOUNDS AND METHODS OF MAKING AND USING SAME METAP2, DNPEP, STS KEAP1 1685/4885NFE2L2 1114/4885METAP2 1/4885
US-20130053364-A1 Sulphone Compounds and Methods of Making and Using Same METAP2, DNPEP, STS KEAP1 1685/4885NFE2L2 1114/4885METAP2 1/4885

“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.