SCHEMBL5744572

SCHEMBL5744572

Cc1ccc(S(=O)(=O)OC2CCN(Cc3ccccc3)CC2)cc1

nearest known ligand 0.57

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CYP2D6 P10635 1/20 0.57
SMN1; SMN2 Q16637 1/20 0.55
LMNA P02545 2/20 0.54
POLB P06746 1/20 0.54
HTR2A P28223 1/20 0.52
ACHE P22303 3/20 0.52
BACE1 P56817 2/20 0.52
ALDH1A1 P00352 3/20 0.52
TSHR P16473 1/20 0.52
CD4 P01730 2/20 0.50
SORT1 Q99523 1/20 0.50
HTR6 P50406 1/20 0.49
HTT P42858 1/20 0.48
GAA P10253 1/20 0.47

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
SCHEMBL3562444 0.93 HTR6 (0.53) CYP2D6SMN1; SMN2LMNAPOLBHTR2A
SCHEMBL952495 0.93 HTR6 (0.53) CYP2D6SMN1; SMN2LMNAPOLBHTR2A
SCHEMBL952496 0.93 HTR6 (0.53) CYP2D6SMN1; SMN2LMNAPOLBHTR2A
SCHEMBL5746064 0.87 LMNA (0.49) CYP2D6SMN1; SMN2LMNAPOLBACHE
SCHEMBL28508903 0.85 BCHE (0.52) CYP2D6SMN1; SMN2ALDH1A1CD4SORT1
SCHEMBL5743312 0.85 BCHE (0.52) CYP2D6SMN1; SMN2ALDH1A1CD4SORT1
SCHEMBL14166152 0.84 SMN1; SMN2 (0.56) SMN1; SMN2LMNAPOLBHTR2AACHE
SCHEMBL22973146 0.83 SMN1; SMN2 (0.48) SMN1; SMN2LMNAPOLBHTR2AACHE
SCHEMBL5743822 0.82 HTR6 (0.50) CYP2D6SMN1; SMN2LMNAPOLBHTR2A
SCHEMBL5743236 0.82 HTR6 (0.50) CYP2D6SMN1; SMN2LMNAPOLBHTR2A

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
EP-3672949-A1 3-(1-OXOISOINDOLIN-2-YL)PIPERIDINE-2,6-DIONE DERIVATIVES AND USES THEREOF Novartis AG (CH) 2020-07-01 EP disclosed
WO-2019038717-A1 3-(1-OXOISOINDOLIN-2-YL)PIPERIDINE-2,6-DIONE DERIVATIVES AND USES THEREOF NOVARTIS AG (CH) 2019-02-28 WO disclosed
EP-1288198-B1 PROCESS FOR THE PRODUCTION OF SULFONIC ESTERS KANEKA CORP (JP) 2006-12-20 EP disclosed
US-6992205-B2 Process for the production of sulfonic esters KANEKA CORPORATION (JP) 2006-01-31 US disclosed
US-6864372-B2 Process for the production of sulfonic esters KANEKA CORPORATION (JP) 2005-03-08 US disclosed
US-6794519-B2 Process for the production of sulfonic esters KANEKA CORPORATION (JP) 2004-09-21 US disclosed
US-20030176713-A1 Reacting an amino alcohol derivative with organic sulfonyl halide in a mixed solvent composed of an aprotic organic solvent and water in presence of a non-water prohibiting inorganic base KANEKA CORPORATION (JP) 2003-09-18 US disclosed
US-20030176711-A1 Process for the production of sulfonic esters KANEKA CORPORATION (JP) 2003-09-18 US disclosed
US-20030162966-A1 PROCESS FOR THE PRODUCTION OF SULFONIC ESTERS KANEKA CORPORATION (JP) 2003-08-28 US disclosed
EP-1288198-A1 PROCESS FOR THE PRODUCTION OF SULFONIC ESTERS KANEKA CORPORATION (JP) 2003-03-05 EP disclosed
US-4950674-A Arylalkylheterocyclic amines,N-substituted by aryloxyalkyl group in a method for allergy treatment A. H. ROBINS COMPANY, INCORPORATED (US) 1990-08-21 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 (3 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-20030162966-A1 PROCESS FOR THE PRODUCTION OF SULFONIC ESTERS TST, STS, SELENOI CYP2D6 675/4885SMN1; SMN2 1882/4885LMNA 3382/4885
US-20030176711-A1 Process for the production of sulfonic esters TST, STS, SELENOI CYP2D6 675/4885SMN1; SMN2 1882/4885LMNA 3382/4885
US-20030176713-A1 Reacting an amino alcohol derivative with organic sulfonyl halide in a mixed solvent composed of an aprotic organic solvent and water in presence of a non-water prohibiting inorganic base BRAF, ADH1C, TST CYP2D6 1620/4885SMN1; SMN2 1828/4885LMNA 2764/4885

“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.