SCHEMBL4649482

SCHEMBL4649482

O=C1O[C@@H](CS(=O)(=O)O)CN1c1cccc(N2CCOCC2)c1

nearest known ligand 0.49

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MAOB P27338 8/20 0.49
MAOA P21397 2/20 0.49
F10 P00742 3/20 0.46
LMNA P02545 1/20 0.45
PTGS1 P23219 1/20 0.45
CALML3 P27482 1/20 0.45
SDHA P31040 1/20 0.45
GRM2 Q14416 6/20 0.45
USP30 Q70CQ3 2/20 0.43
KMO O15229 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
SCHEMBL5432675 1.00 MAOB (0.49) MAOBMAOAF10LMNAPTGS1
SCHEMBL4647201 0.85 MAOB (0.67) MAOBMAOAF10LMNAPTGS1
SCHEMBL4647204 0.85 MAOB (0.67) MAOBMAOAF10LMNAPTGS1
SCHEMBL28809355 0.83 F10 (0.60) MAOBMAOAF10LMNAPTGS1
SCHEMBL28809356 0.83 F10 (0.60) MAOBMAOAF10LMNAPTGS1
SCHEMBL27482757 0.80 MAOB (0.44) MAOBMAOALMNAPTGS1CALML3
SCHEMBL27977654 0.79 MAOB (0.71) MAOBMAOAF10LMNAPTGS1
SCHEMBL27977656 0.79 MAOB (0.71) MAOBMAOAF10LMNAPTGS1
SCHEMBL27483134 0.78 USP30 (0.48) MAOBMAOALMNAPTGS1CALML3
SCHEMBL27552942 0.77 RPS6KA3 (0.47) MAOBMAOAF10LMNAPTGS1

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-1960374-A1 ISOLATED DESFLUORO-LINEZOLID, PREPARATION THEREOF AND ITS USE AS A REFERENCE MARKER AND STANDARD TEVA PHARMACEUTICAL INDUSTRIES LTD. (IL) 2008-08-27 EP disclosed
US-20070197529-A1 Isolated desfluoro-linezolid, preparation thereof and its use as a reference marker and standard TEVA PHARMACEUTICALS USA, INC. 2007-08-23 US disclosed
WO-2007064818-A1 ISOLATED DESFLUORO-LINEZOLID, PREPARATION THEREOF AND ITS USE AS A REFERENCE MARKER AND STANDARD TEVA PHARMACEUTICAL INDUSTRIES LTD. (IL) 2007-06-07 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-20070197529-A1 Isolated desfluoro-linezolid, preparation thereof and its use as a reference marker and standard MLLT3, DAO, FHIT MAOB 2084/4885MAOA 1747/4885F10 1266/4885

“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.