SCHEMBL5675347

SCHEMBL5675347

CCN(CCOS(C)(=O)=O)Cc1ccccc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOB P27338 8/20 0.49
TSHR P16473 1/20 0.46
MAPK1 P28482 1/20 0.46
BCHE P06276 4/20 0.46
ACHE P22303 3/20 0.46
CYP1A2 P05177 1/20 0.45
LTA4H P09960 1/20 0.45
CYP2D6 P10635 1/20 0.45
CYP2C9 P11712 1/20 0.45
CYP2C19 P33261 1/20 0.45
HTT P42858 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.44
KDM4E B2RXH2 2/20 0.44
CNR2 P34972 1/20 0.44
CA12 O43570 1/20 0.43
CA1 P00915 1/20 0.43
CA2 P00918 1/20 0.43
DRD2 P14416 1/20 0.43
DRD1 P21728 1/20 0.43
DRD3 P35462 1/20 0.43

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
SCHEMBL5672847 0.92 MCHR1 (0.45) MAOBTSHRL3MBTL1CNR2CA1
SCHEMBL5743428 0.91 MAOB (0.51) MAOBBCHEACHEDRD1DRD3
SCHEMBL24012573 0.82 HDAC3 (0.45) MAOBTSHRBCHEACHEKDM4E
SCHEMBL14192202 0.82 MCHR1 (0.55) MAOBCNR2CA12CA1CA2
SCHEMBL5746057 0.80 SMN1; SMN2 (0.55) MAOBTSHRBCHEACHE
SCHEMBL5673877 0.80 MAOB (0.51) MAOBTSHRMAPK1BCHEACHE
SCHEMBL615299 0.80 TSHR (0.56) MAOBTSHRMAPK1BCHEACHE
SCHEMBL4902679 0.79 HDAC3 (0.49) MAOBTSHRBCHEACHEKDM4E
SCHEMBL4499222 0.79 SMN1; SMN2 (0.51) TSHRCYP1A2CYP2D6CYP2C9CYP2C19
SCHEMBL14890694 0.78 TSHR (0.50) TSHRCYP1A2CYP2D6KDM4E

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-1288198-B1 PROCESS FOR THE PRODUCTION OF SULFONIC ESTERS KANEKA CORP (JP) 2006-12-20 EP disclosed
EP-1549761-A4 METHODS AND COMPOSITIONS FOR THE MODIFICATION OF NUCLEIC ACIDS VI TECHNOLOGIES INC (US) 2006-02-15 EP disclosed
US-6992205-B2 Process for the production of sulfonic esters KANEKA CORPORATION (JP) 2006-01-31 US disclosed
EP-1549761-A1 METHODS AND COMPOSITIONS FOR THE MODIFICATION OF NUCLEIC ACIDS V.I. Technologies, Inc. (US) 2005-07-06 EP 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
WO-2003093512-A1 METHODS AND COMPOSITIONS FOR THE MODIFICATION OF NUCLEIC ACIDS V.I. TECHNOLOGIES, INC. (US) 2003-11-13 WO 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

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 MAOB 3129/4885TSHR 467/4885MAPK1 816/4885
US-20030176711-A1 Process for the production of sulfonic esters TST, STS, SELENOI MAOB 3129/4885TSHR 467/4885MAPK1 816/4885
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 MAOB 3182/4885TSHR 395/4885MAPK1 1036/4885

“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.