SCHEMBL2025534

SCHEMBL2025534

Cc1cc(N2CCNCC2)cc2c1C(=O)N(Cc1ccc(OC(F)(F)F)cc1)C2

nearest known ligand 0.62

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
GRM2 Q14416 3/20 0.62
HTR2C P28335 3/20 0.43
ALDH1A1 P00352 1/20 0.41
TSHR P16473 1/20 0.38
GRIN2B Q13224 1/20 0.38
CHRM5 P08912 2/20 0.37
MCHR1 Q99705 3/20 0.37
DDR1 Q08345 1/20 0.37
HCRTR1 O43613 1/20 0.36
HCRTR2 O43614 1/20 0.36
TYMS P04818 1/20 0.36
SCN4A P35499 1/20 0.35
SCN9A Q15858 1/20 0.35
ADRB1 P08588 2/20 0.35
PPARG P37231 1/20 0.35
PPARD Q03181 1/20 0.35
PPARA Q07869 1/20 0.35

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
SCHEMBL2028589 0.90 GRM2 (0.53) GRM2HTR2CALDH1A1TSHRGRIN2B
SCHEMBL2028720 0.88 GRM2 (0.53) GRM2ALDH1A1TSHRGRIN2BCHRM5
SCHEMBL2022488 0.87 GRM2 (0.51) GRM2ALDH1A1TSHRGRIN2BCHRM5
SCHEMBL2023238 0.84 GRM2 (0.54) GRM2ALDH1A1TSHRCHRM5SCN9A
SCHEMBL2027356 0.84 GRM2 (0.51) GRM2ALDH1A1TSHRGRIN2BPPARD
SCHEMBL2023300 0.84 GRM2 (0.50) GRM2ALDH1A1TSHRGRIN2BPPARD
SCHEMBL2022290 0.83 GRM2 (0.49) GRM2HTR2CALDH1A1TSHRGRIN2B
SCHEMBL2331184 0.83 GRM2 (0.48) GRM2HTR2CALDH1A1HCRTR1HCRTR2
SCHEMBL2029723 0.82 GRM2 (0.56) GRM2HTR2CALDH1A1TSHRGRIN2B
SCHEMBL2025669 0.82 GRM2 (0.49) GRM2HTR2CALDH1A1TSHRGRIN2B

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-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
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 4/4885HTR2C 616/4885ALDH1A1 1582/4885

“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.