SCHEMBL8227799

SCHEMBL8227799

O=C1O[C@H](c2ccccc2)CN1Cc1ccc(CN2CCOCC2)cc1

nearest known ligand 0.53

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 7/20 0.53
FADS1 O60427 1/20 0.52
GRM2 Q14416 1/20 0.48
CNR2 P34972 3/20 0.47
HRH3 Q9Y5N1 1/20 0.47
HIF1A Q16665 1/20 0.45
EPAS1 Q99814 1/20 0.45
NPC1 O15118 1/20 0.44
HTT P42858 1/20 0.44
RAB9A P51151 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
ALDH1A1 P00352 1/20 0.44
TSHR P16473 1/20 0.44
PARP1 P09874 1/20 0.44

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
SCHEMBL2901954 0.89 FADS1 (0.51) LTA4HFADS1GRM2SMN1; SMN2ALDH1A1
SCHEMBL2901957 0.89 FADS1 (0.51) LTA4HFADS1GRM2SMN1; SMN2ALDH1A1
SCHEMBL4328591 0.88 DRD4 (0.54) FADS1GRM2
SCHEMBL4328587 0.88 DRD4 (0.54) FADS1GRM2
SCHEMBL2895926 0.88 FADS1 (0.55) LTA4HFADS1ALDH1A1TSHR
SCHEMBL2901488 0.86 SIGMAR1 (0.52) LTA4HFADS1GRM2CNR2HRH3
SCHEMBL2901485 0.86 SIGMAR1 (0.52) LTA4HFADS1GRM2CNR2HRH3
SCHEMBL4325271 0.86 MC4R (0.52) LTA4HFADS1GRM2NPC1RAB9A
SCHEMBL4325275 0.86 MC4R (0.52) LTA4HFADS1GRM2NPC1RAB9A
SCHEMBL4325296 0.86 GRM2 (0.56) LTA4HFADS1GRM2HRH3NPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7816354-B2 Oxazolidinone compounds and their use as metabotropic glutamate receptor potentiators ASTRAZENECA AB (SE) 2010-10-19 US disclosed
US-7816354-B2 Oxazolidinone compounds and their use as metabotropic glutamate receptor potentiators ASTRAZENECA AB (SE) 2010-10-19 US disclosed
US-20090012089-A1 Oxazolidinone Compounds and Their Use as Metabotropic Glutamate Receptor Potentiators ASTRAZENECA AB (SE) 2009-01-08 US disclosed
US-20090012089-A1 Oxazolidinone Compounds and Their Use as Metabotropic Glutamate Receptor Potentiators ASTRAZENECA AB (SE) 2009-01-08 US disclosed
US-20070275966-A1 Oxazolidinone compounds and their use as metabotropic glutamate receptor potentiators NPS PHARMACEUTICALS, INC. (US) 2007-11-29 US disclosed
US-20070275966-A1 Oxazolidinone compounds and their use as metabotropic glutamate receptor potentiators NPS PHARMACEUTICALS, INC. (US) 2007-11-29 US disclosed
WO-2007078523-A2 5-PHENYL-3-BENZYL-0XAZ0LIDIN-2-0NE DERIVATIVES AND RELATED COMPOUNDS AS METABOTROPIC GLUTAMATE RECEPTOR POTENTIATORS FOR THE TREATMENT OF NEUROLOGICAL AND PSYCHIATRIC DISORDERS ASTRAZENECA AB (SE) 2007-07-12 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 (2 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-20070275966-A1 Oxazolidinone compounds and their use as metabotropic glutamate receptor potentiators GRM1, GRIN1, GRM2 LTA4H 2150/4885FADS1 4353/4885GRM2 3/4885
US-20090012089-A1 Oxazolidinone Compounds and Their Use as Metabotropic Glutamate Receptor Potentiators GRM1, GRIN1, GRM2 LTA4H 2150/4885FADS1 4353/4885GRM2 3/4885

“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.