SCHEMBL2026121

SCHEMBL2026121

Cc1cc(OCCN2CCN(C)CC2)cc2c1C(=O)N(Cc1ccc(OC(F)(F)F)cc1)C2

nearest known ligand 0.53

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
GRM2 Q14416 1/20 0.53
ALDH1A1 P00352 2/20 0.52
TSHR P16473 1/20 0.42
ESR1 P03372 1/20 0.41
KCNA5 P22460 2/20 0.41
MAOB P27338 2/20 0.41
LTA4H P09960 1/20 0.40
SIGMAR1 Q99720 1/20 0.40
HRH2 P25021 1/20 0.39
HRH1 P35367 1/20 0.39
KDM4E B2RXH2 1/20 0.39
HRH3 Q9Y5N1 2/20 0.39
GRIN2B Q13224 1/20 0.39
HTR6 P50406 2/20 0.39
ABL1 P00519 1/20 0.39

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
SCHEMBL12641852 0.87 ESR1 (0.44) ALDH1A1ESR1MAOBLTA4HSIGMAR1
SCHEMBL2027582 0.87 ALDH1A1 (0.62) GRM2ALDH1A1TSHRKDM4EGRIN2B
SCHEMBL12581809 0.85 GRM2 (0.53) GRM2ALDH1A1TSHRGRIN2B
SCHEMBL2023966 0.85 GRM2 (0.53) GRM2ALDH1A1TSHRHRH2HRH1
SCHEMBL2022286 0.85 GRM2 (0.50) GRM2ALDH1A1TSHRHRH3GRIN2B
SCHEMBL2026704 0.84 GRM2 (0.50) GRM2ALDH1A1MAOBGRIN2B
SCHEMBL2029663 0.83 GRM2 (0.55) GRM2ALDH1A1TSHRGRIN2B
SCHEMBL2027356 0.83 GRM2 (0.51) GRM2ALDH1A1TSHRESR1HRH3
SCHEMBL2026015 0.83 GRM2 (0.51) GRM2ALDH1A1TSHRGRIN2B
SCHEMBL2028589 0.83 GRM2 (0.53) GRM2ALDH1A1TSHRGRIN2BABL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2357169-A1 Isoindolone compounds and their use as metabotropic glutamate receptor potentiators AstraZeneca AB (SE) 2011-08-17 EP disclosed
EP-2357169-A1 Isoindolone compounds and their use as metabotropic glutamate receptor potentiators AstraZeneca AB (SE) 2011-08-17 EP 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
EP-1778634-A1 ISOINDOLONE COMPOUNDS AND THEIR USE AS METABOTROPIC GLUTAMATE RECEPTOR POTENTIATORS AstraZeneca AB (SE) 2007-05-02 EP disclosed
WO-2006020879-A1 ISOINDOLONE COMPOUNDS AND THEIR USE AS METABOTROPIC GLUTAMATE RECEPTOR POTENTIATORS ASTRAZENECA AB (SE) 2006-02-23 WO disclosed
WO-2006020879-A1 ISOINDOLONE COMPOUNDS AND THEIR USE AS METABOTROPIC GLUTAMATE RECEPTOR POTENTIATORS ASTRAZENECA AB (SE) 2006-02-23 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-20090275578-A1 Isoindolone compounds and their use as metabotropic glutamate receptor potentiators GRM1, GRIN1, GRM3 GRM2 4/4885ALDH1A1 1582/4885TSHR 408/4885

“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.