SCHEMBL2027205

SCHEMBL2027205

Cc1cc(CN(C)CC2CCN(C)CC2)cc2c1C(=O)N(Cc1ccc(OC(F)(F)F)cc1)C2

nearest known ligand 0.48

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
GRM2 Q14416 3/20 0.48
ALDH1A1 P00352 1/20 0.41
HTR2A P28223 1/20 0.41
TSHR P16473 1/20 0.37
HCRTR1 O43613 9/20 0.37
HCRTR2 O43614 9/20 0.37
LSS P48449 1/20 0.35
SLC6A4 P31645 2/20 0.35
SLC6A3 Q01959 2/20 0.35
GRIN2B Q13224 1/20 0.35
CHRM5 P08912 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
SCHEMBL2023907 0.91 GRM2 (0.53) GRM2ALDH1A1TSHRHCRTR1HCRTR2
SCHEMBL2022161 0.88 GRM2 (0.51) GRM2ALDH1A1HTR2ATSHRHCRTR1
SCHEMBL2028582 0.86 GRM2 (0.49) GRM2ALDH1A1HTR2ATSHRHCRTR1
SCHEMBL2022914 0.85 GRM2 (0.53) GRM2ALDH1A1TSHRHCRTR1HCRTR2
SCHEMBL2022432 0.84 GRM2 (0.50) GRM2ALDH1A1TSHRHCRTR1HCRTR2
SCHEMBL2026704 0.83 GRM2 (0.50) GRM2ALDH1A1HTR2AHCRTR1HCRTR2
SCHEMBL2021868 0.82 GRM2 (0.51) GRM2ALDH1A1TSHRHCRTR1HCRTR2
SCHEMBL2026784 0.82 GRM2 (0.49) GRM2ALDH1A1HTR2ATSHRHCRTR1
SCHEMBL2029729 0.82 GRM2 (0.52) GRM2ALDH1A1HTR2ATSHRHCRTR1
SCHEMBL2027582 0.82 ALDH1A1 (0.62) GRM2ALDH1A1TSHRLSSSLC6A4

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 4/4885ALDH1A1 1582/4885HTR2A 701/4885

“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.