SCHEMBL1649460

SCHEMBL1649460

COC(=O)c1c(CS(=O)(=O)c2ccc(F)cc2C=CCO)ccc(Br)c1OC

nearest known ligand 0.43

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
METAP2 P50579 9/20 0.43
PTGES2 Q9H7Z7 3/20 0.33
ALDH1A1 P00352 1/20 0.32
KRAS P01116 1/20 0.32
ATM Q13315 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
BDKRB1 P46663 1/20 0.32
GAA P10253 1/20 0.31
KCNH2 Q12809 1/20 0.31
POLB P06746 1/20 0.31

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
SCHEMBL1649459 1.00 METAP2 (0.43) METAP2PTGES2ALDH1A1KRASATM
SCHEMBL6844921 1.00 METAP2 (0.43) METAP2PTGES2ALDH1A1KRASATM
SCHEMBL1649449 0.92 METAP2 (0.42) METAP2ALDH1A1SMN1; SMN2GAA
SCHEMBL14717298 0.91 METAP2 (0.48) METAP2PTGES2ALDH1A1KRASATM
SCHEMBL14717297 0.91 METAP2 (0.48) METAP2PTGES2ALDH1A1KRASATM
SCHEMBL436523 0.89 METAP2 (0.57) METAP2PTGES2KCNH2
SCHEMBL462418 0.89 METAP2 (0.42) METAP2PTGES2POLB
SCHEMBL462796 0.89 METAP2 (0.57) METAP2PTGES2KCNH2
SCHEMBL462417 0.89 METAP2 (0.42) METAP2PTGES2POLB
SCHEMBL14717510 0.89 METAP2 (0.57) METAP2PTGES2KCNH2

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 6 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
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

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 1/4885PTGES2 524/4885ALDH1A1 360/4885
US-20130053364-A1 Sulphone Compounds and Methods of Making and Using Same METAP2, DNPEP, STS METAP2 1/4885PTGES2 524/4885ALDH1A1 360/4885

“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.