SCHEMBL12469834

SCHEMBL12469834

O=C(O)c1c(NS(=O)(=O)c2ccccc2)sc2c1CCCC2

nearest known ligand 0.72

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACLY P53396 2/20 0.72
ALDH1A1 P00352 6/20 0.71
LMNA P02545 6/20 0.71
HTT P42858 2/20 0.71
GAA P10253 2/20 0.71
CRHBP P24387 1/20 0.71
CRHR2 Q13324 1/20 0.71
CNR2 P34972 1/20 0.71
MEN1 O00255 9/20 0.60
KMT2A Q03164 9/20 0.60
RAB9A P51151 4/20 0.60
NPC1 O15118 3/20 0.60
MAPT P10636 6/20 0.59
SMN1; SMN2 Q16637 5/20 0.59
KCNH2 Q12809 1/20 0.59
POLB P06746 2/20 0.57
HPGD P15428 2/20 0.57
ESR2 Q92731 1/20 0.57
CTDSP1 Q9GZU7 1/20 0.57
TDP1 Q9NUW8 1/20 0.57

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
SCHEMBL12470056 0.97 ACLY (0.72) ACLYALDH1A1LMNAHTTGAA
SCHEMBL15199355 0.90 ALDH1A1 (0.72) ACLYALDH1A1LMNAHTTGAA
SCHEMBL12469929 0.89 ACLY (0.67) ACLYALDH1A1LMNAHTTGAA
SCHEMBL12469993 0.89 ACLY (0.78) ACLYALDH1A1LMNAHTTGAA
SCHEMBL15199396 0.87 ALDH1A1 (0.69) ACLYALDH1A1LMNAHTTGAA
SCHEMBL12470505 0.87 ACLY (0.79) ACLYALDH1A1LMNAHTTGAA
SCHEMBL12469719 0.85 CNR2 (0.60) ACLYALDH1A1LMNAHTTGAA
SCHEMBL12469970 0.84 ALDH1A1 (0.74) ACLYALDH1A1LMNAHTTGAA
SCHEMBL12469717 0.84 MEN1 (0.60) ACLYALDH1A1LMNAHTTGAA
SCHEMBL12470051 0.84 ACLY (0.65) ACLYALDH1A1LMNAHTTGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20130217759-A1 Sulphonamine Compounds and Methods of Making and Using Same ZAFGEN INC. (US) 2013-08-22 US claimed
EP-2627632-A1 SULPHONAMIDE COMPOUNDS AND METHODS OF MAKING AND USING SAME Zafgen, Inc. (US) 2013-08-21 EP claimed
WO-2012051318-A1 SULPHONAMIDE COMPOUNDS AND METHODS OF MAKING AND USING SAME ZAFGEN CORPORATION (US) 2012-04-19 WO claimed
US-9221787-B2 Sulphonamine compounds and methods of making and using same ZAFGEN, INC. (US) 2015-12-29 US disclosed
US-9221787-B2 Sulphonamine compounds and methods of making and using same ZAFGEN, INC. (US) 2015-12-29 US disclosed
US-9221787-B2 Sulphonamine compounds and methods of making and using same ZAFGEN, INC. (US) 2015-12-29 US disclosed
US-20130217759-A1 Sulphonamine Compounds and Methods of Making and Using Same ZAFGEN INC. (US) 2013-08-22 US disclosed
US-20130217759-A1 Sulphonamine Compounds and Methods of Making and Using Same ZAFGEN INC. (US) 2013-08-22 US disclosed
US-20130217759-A1 Sulphonamine Compounds and Methods of Making and Using Same ZAFGEN INC. (US) 2013-08-22 US disclosed
EP-2627632-A1 SULPHONAMIDE COMPOUNDS AND METHODS OF MAKING AND USING SAME Zafgen, Inc. (US) 2013-08-21 EP disclosed
WO-2012051318-A1 SULPHONAMIDE COMPOUNDS AND METHODS OF MAKING AND USING SAME ZAFGEN CORPORATION (US) 2012-04-19 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 (1 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-20130217759-A1 Sulphonamine Compounds and Methods of Making and Using Same DNPEP, METAP2, ANPEP ACLY 1062/4885ALDH1A1 957/4885LMNA 4374/4885

“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.