SCHEMBL5164806

SCHEMBL5164806

COc1ccccc1S(=O)(=O)NCc1ccccc1OC(C)C

nearest known ligand 0.61

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 4/20 0.53
▸ KMT2A Q03164 4/20 0.53
▸ KDM4E B2RXH2 1/20 0.51
▸ POLB P06746 1/20 0.51
▸ HTT P42858 1/20 0.51
▸ GAA P10253 1/20 0.50
▸ LMNA P02545 1/20 0.50
▸ SMN1; SMN2 Q16637 1/20 0.48
▸ ALDH1A1 P00352 2/20 0.46
▸ L3MBTL1 Q9Y468 1/20 0.46
▸ TDP1 Q9NUW8 1/20 0.46

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
SCHEMBL5165402 0.82 GAA (0.64) MEN1KMT2AKDM4EPOLBHTT
SCHEMBL5163986 0.81 MEN1 (0.52) MEN1KMT2AKDM4EPOLBHTT
SCHEMBL30733139 0.81 MEN1 (0.52) MEN1KMT2AKDM4EPOLBHTT
SCHEMBL5164811 0.80 GAA (0.55) MEN1KMT2AKDM4EPOLBHTT
SCHEMBL5165214 0.75 MEN1 (0.48) MEN1KMT2AKDM4EPOLBHTT
SCHEMBL5165342 0.75 ALDH1A1 (0.52) MEN1KMT2AGAASMN1; SMN2ALDH1A1
SCHEMBL12393346 0.74 GBA1 (0.49) KMT2ASMN1; SMN2ALDH1A1L3MBTL1
SCHEMBL29660937 0.74 GAA (0.72) MEN1KMT2AKDM4EPOLBHTT
SCHEMBL4661701 0.74 GAA (0.72) MEN1KMT2AKDM4EPOLBHTT
SCHEMBL5165487 0.74 GAA (0.51) MEN1KMT2AKDM4EHTTGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1765332-A2 TRISUBSTITUTED NITROGEN MODULATORS OF TYROSINE PHOSPHATASES Cengent Therapeutics, Inc. (US) 2007-03-28 — — EP disclosed
US-20060135773-A1 Trisubstituted nitrogen modulators of tyrosine phosphatases METABASIS THERAPEUTICS, INC. 2006-06-22 — — US disclosed
WO-2006009876-A2 TRISUBSTITUTED NITROGEN MODULATORS OF TYROSINE PHOSPHATASES CENGENT THERAPEUTICS, INC. (US) 2006-01-26 — — 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-20060135773-A1 Trisubstituted nitrogen modulators of tyrosine phosphatases PTPA, PTPN1, PTPRS MEN1 4371/4885KMT2A 1237/4885KDM4E 345/4885

“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.

Send feedback