SCHEMBL2022336

SCHEMBL2022336

COCCCNCc1cc(C)c2c(c1)CN(Cc1ccc(OC(F)(F)F)cc1)C2=O

nearest known ligand 0.48

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
GRM2 Q14416 2/20 0.48
SCN8A Q9UQD0 2/20 0.46
GRIN2B Q13224 1/20 0.36
ALDH1A1 P00352 1/20 0.36
KDM4E B2RXH2 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
CYP3A4 P08684 1/20 0.35
CYP2C19 P33261 1/20 0.35
CHRM5 P08912 3/20 0.35
SMURF2 Q9HAU4 1/20 0.35
SMURF1 Q9HCE7 1/20 0.35
HCRTR1 O43613 3/20 0.34
HCRTR2 O43614 3/20 0.34
MCHR1 Q99705 1/20 0.34
TSHR P16473 1/20 0.34
TYMS P04818 1/20 0.34

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
SCHEMBL2030934 0.88 GRM2 (0.46) GRM2SCN8AGRIN2B
SCHEMBL2024512 0.87 GRM2 (0.51) GRM2SCN8AGRIN2BALDH1A1CHRM5
SCHEMBL2022433 0.86 GRM2 (0.48) GRM2SCN8AGRIN2BALDH1A1
SCHEMBL2024477 0.85 GRM2 (0.50) GRM2SCN8AGRIN2BALDH1A1CHRM5
SCHEMBL2026781 0.84 GRM2 (0.51) GRM2SCN8AGRIN2BALDH1A1CHRM5
SCHEMBL2022171 0.83 GRM2 (0.48) GRM2SCN8AGRIN2BALDH1A1CHRM5
SCHEMBL12441933 0.83 GRM2 (0.56) GRM2GRIN2BALDH1A1CHRM5HCRTR1
SCHEMBL2024263 0.81 GRM2 (0.54) GRM2GRIN2BALDH1A1CYP3A4CHRM5
SCHEMBL2022847 0.81 GRM2 (0.54) GRM2GRIN2BALDH1A1CHRM5HCRTR1
SCHEMBL2026540 0.81 GRM2 (0.48) GRM2ALDH1A1KDM4ETDP1CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7968570-B2 Isoindolone compounds and their use as metabotropic glutamate receptor potentiators ASTRAZENECA AB (SE) 2011-06-28 US disclosed
US-7968570-B2 Isoindolone compounds and their use as metabotropic glutamate receptor potentiators ASTRAZENECA AB (SE) 2011-06-28 US disclosed
US-7968570-B2 Isoindolone compounds and their use as metabotropic glutamate receptor potentiators ASTRAZENECA AB (SE) 2011-06-28 US disclosed
US-20090275578-A1 Isoindolone compounds and their use as metabotropic glutamate receptor potentiators ASTRAZENECA AB (SE) 2009-11-05 US disclosed
US-20090275578-A1 Isoindolone compounds and their use as metabotropic glutamate receptor potentiators ASTRAZENECA AB (SE) 2009-11-05 US disclosed
US-20090275578-A1 Isoindolone compounds and their use as metabotropic glutamate receptor potentiators ASTRAZENECA AB (SE) 2009-11-05 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 (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-20090275578-A1 Isoindolone compounds and their use as metabotropic glutamate receptor potentiators GRM1, GRIN1, GRM3 GRM2 4/4885SCN8A 1301/4885GRIN2B 16/4885

“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.