SCHEMBL1648688

SCHEMBL1648688

Nc1c(-c2ccoc2)ccc(CS(=O)(=O)c2ccccc2)c1C(=O)O

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NAT1 P18440 3/20 0.38
METAP2 P50579 2/20 0.37
ALOX5AP P20292 1/20 0.36
TSHR P16473 1/20 0.35
HSD17B10 Q99714 1/20 0.35
PLAU P00749 3/20 0.34
ALOX5 P09917 1/20 0.34
PTGES2 Q9H7Z7 1/20 0.33
HDAC2 Q92769 1/20 0.33
PLG P00747 2/20 0.32
PLAT P00750 2/20 0.32
KLK1 P06870 2/20 0.32
F2 P00734 1/20 0.32
PRSS1 P07477 1/20 0.32
NPC1 O15118 1/20 0.32
LMNA P02545 1/20 0.32
RAB9A P51151 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
CNR2 P34972 1/20 0.32
ADORA2A P29274 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
SCHEMBL1648203 0.88 METAP2 (0.39) NAT1METAP2ALOX5APPTGES2LMNA
SCHEMBL1648039 0.87 NAT1 (0.39) NAT1METAP2ALOX5APTSHRHSD17B10
SCHEMBL6844907 0.86 METAP2 (0.39) NAT1METAP2TSHRHSD17B10ALOX5
SCHEMBL1648400 0.85 METAP2 (0.39) NAT1METAP2ALOX5APTSHRHSD17B10
SCHEMBL14725681 0.84 NAT1 (0.35) NAT1METAP2ALOX5APTSHRHSD17B10
SCHEMBL1647756 0.83 METAP2 (0.53) NAT1METAP2NPC1RAB9ASMN1; SMN2
SCHEMBL1648374 0.83 METAP2 (0.40) NAT1METAP2ALOX5APTSHRHSD17B10
Hydrochloric Acid SCHEMBL1648037 0.83 NAT1 (0.34) NAT1METAP2ALOX5APTSHRHSD17B10
SCHEMBL14725678 0.83 NAT1 (0.36) NAT1METAP2ALOX5APTSHRHSD17B10
Hydrochloric Acid SCHEMBL1647973 0.83 NAT1 (0.36) NAT1METAP2ALOX5APTSHRHSD17B10

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 NAT1 136/4885METAP2 1/4885ALOX5AP 1081/4885
US-20130053364-A1 Sulphone Compounds and Methods of Making and Using Same METAP2, DNPEP, STS NAT1 136/4885METAP2 1/4885ALOX5AP 1081/4885

“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.