SCHEMBL1648200

SCHEMBL1648200

COC(=O)c1c(CS(=O)(=O)c2ccccc2)ccc2c(Br)ccc(OC)c12

nearest known ligand 0.41

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 1/20 0.41
ALDH1A1 P00352 3/20 0.39
POLB P06746 2/20 0.39
HSD11B1 P28845 1/20 0.38
L3MBTL1 Q9Y468 3/20 0.38
KEAP1 Q14145 5/20 0.37
NFE2L2 Q16236 3/20 0.37
LMNA P02545 1/20 0.36
PKM P14618 2/20 0.36
NPC1 O15118 1/20 0.36
RAB9A P51151 1/20 0.36
TP53 P04637 1/20 0.35
KDM4E B2RXH2 1/20 0.35

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
SCHEMBL28800086 0.83 PTGDR2 (0.39) KMT2AALDH1A1POLBHSD11B1L3MBTL1
SCHEMBL28104552 0.82 KMT2A (0.41) KMT2AALDH1A1POLBHSD11B1L3MBTL1
SCHEMBL435766 0.82 ALDH1A1 (0.44) KMT2AALDH1A1POLBHSD11B1L3MBTL1
SCHEMBL1648418 0.81 KMT2A (0.46) KMT2AALDH1A1POLBHSD11B1L3MBTL1
SCHEMBL434726 0.80 POLB (0.41) KMT2AALDH1A1POLBHSD11B1L3MBTL1
SCHEMBL1649038 0.80 HDAC1 (0.36) KMT2AALDH1A1L3MBTL1LMNAPKM
SCHEMBL18801354 0.80 HSD11B1 (0.35) KMT2AALDH1A1POLBHSD11B1L3MBTL1
SCHEMBL18801355 0.79 L3MBTL1 (0.42) KMT2AALDH1A1L3MBTL1NPC1RAB9A
SCHEMBL1648626 0.78 KMT2A (0.54) KMT2AALDH1A1POLBHSD11B1L3MBTL1
SCHEMBL28104556 0.77 KEAP1 (0.35) KMT2AALDH1A1POLBHSD11B1KEAP1

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
CN-102639494-B Sulphones and preparation and application thereof 扎夫根公司 2016-11-09 CN 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
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 KMT2A 666/4885ALDH1A1 360/4885POLB 3162/4885
US-20130053364-A1 Sulphone Compounds and Methods of Making and Using Same METAP2, DNPEP, STS KMT2A 666/4885ALDH1A1 360/4885POLB 3162/4885

“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.