SCHEMBL14717508

SCHEMBL14717508

COC(=O)c1c(CS(=O)(=O)c2ccccc2/C=C/CN2CCCCC2)ccc(Br)c1OC

nearest known ligand 0.42

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
METAP2 P50579 3/20 0.42
ALDH1A1 P00352 6/20 0.37
LMNA P02545 2/20 0.37
KMT2A Q03164 4/20 0.37
MEN1 O00255 3/20 0.37
ALOX15 P16050 1/20 0.36
KDM4E B2RXH2 3/20 0.36
TSHR P16473 2/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
L3MBTL1 Q9Y468 2/20 0.34
TDP1 Q9NUW8 1/20 0.34
MAPT P10636 1/20 0.34
MAPK1 P28482 1/20 0.34
RECQL P46063 1/20 0.34
APP P05067 1/20 0.33

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
SCHEMBL14717509 1.00 METAP2 (0.42) METAP2ALDH1A1LMNAKMT2AMEN1
SCHEMBL1648351 1.00 METAP2 (0.42) METAP2ALDH1A1LMNAKMT2AMEN1
SCHEMBL1648539 0.92 METAP2 (0.47) METAP2ALDH1A1LMNAKMT2AMEN1
SCHEMBL14718068 0.92 METAP2 (0.47) METAP2ALDH1A1LMNAKMT2AMEN1
SCHEMBL1649278 0.87 ALDH1A1 (0.34) METAP2ALDH1A1LMNAKDM4E
SCHEMBL14725743 0.87 ALDH1A1 (0.34) METAP2ALDH1A1LMNAKDM4E
SCHEMBL1648308 0.87 ALDH1A1 (0.34) METAP2ALDH1A1LMNAKDM4E
SCHEMBL6844943 0.84 METAP2 (0.39) METAP2ALDH1A1LMNAKMT2AMEN1
SCHEMBL1648256 0.79 PLCG1 (0.41) ALDH1A1LMNAKMT2AMEN1KDM4E
SCHEMBL1648544 0.78 METAP2 (0.35) METAP2TSHRSMN1; SMN2

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 4 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
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-20130053364-A1 Sulphone Compounds and Methods of Making and Using Same ZAFGEN, INC. 2013-02-28 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 (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 METAP2 1/4885ALDH1A1 360/4885LMNA 4621/4885
US-20130053364-A1 Sulphone Compounds and Methods of Making and Using Same METAP2, DNPEP, STS METAP2 1/4885ALDH1A1 360/4885LMNA 4621/4885

“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.