SCHEMBL12413544

SCHEMBL12413544

Cc1cc2c(c(C(F)(F)F)c1)C(=O)N(Cc1ccc(OC(F)(F)F)cc1)C2

nearest known ligand 0.49

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
GRM2 Q14416 3/20 0.49
GRIN2B Q13224 2/20 0.47
ALDH1A1 P00352 1/20 0.43
HCRTR2 O43614 5/20 0.42
HCRTR1 O43613 4/20 0.42
CHRM5 P08912 4/20 0.41
TSHR P16473 1/20 0.41
HTR2C P28335 1/20 0.39
PHGDH O43175 1/20 0.38

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
SCHEMBL2022219 0.89 GRM2 (0.46) GRM2GRIN2BALDH1A1HCRTR2HCRTR1
SCHEMBL1003022 0.88 CHRM5 (0.47) GRM2GRIN2BALDH1A1HCRTR2HCRTR1
SCHEMBL2022287 0.88 GRM2 (0.45) GRM2GRIN2BALDH1A1HCRTR2HCRTR1
SCHEMBL1003383 0.87 GRM2 (0.47) GRM2GRIN2BALDH1A1HCRTR2HCRTR1
SCHEMBL12581822 0.87 GRM2 (0.51) GRM2GRIN2BALDH1A1HCRTR2HCRTR1
SCHEMBL2022956 0.86 GRM2 (0.44) GRM2GRIN2BALDH1A1HCRTR2HCRTR1
SCHEMBL12413546 0.86 HCRTR1 (0.52) GRM2GRIN2BHCRTR2HCRTR1
SCHEMBL1000919 0.84 GRM2 (0.45) GRM2GRIN2BALDH1A1HCRTR2HCRTR1
SCHEMBL12581714 0.84 GRM2 (0.45) GRM2GRIN2BALDH1A1HCRTR2HCRTR1
SCHEMBL2021006 0.83 ALDH1A1 (0.49) GRM2GRIN2BALDH1A1HCRTR2HCRTR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110166155-A1 Substituted Isoindolones and Their Use as Metabotropic Glutamate Receptor Potentiators VAN WAGENEN BRADFORD 2011-07-07 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-20110166155-A1 Substituted Isoindolones and Their Use as Metabotropic Glutamate Receptor Potentiators GRM1, GRIN1, GRM2 GRM2 3/4885GRIN2B 11/4885ALDH1A1 1757/4885

“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.