SCHEMBL2028083

SCHEMBL2028083

Cc1cc(N2CCN(CC3CCCN(C)C3)CC2)cc2c1C(=O)N(Cc1ccc(OC(F)(F)F)cc1)C2

nearest known ligand 0.47

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
GRM2 Q14416 2/20 0.47
ALDH1A1 P00352 1/20 0.42
CHRM4 P08173 6/20 0.38
HCRTR1 O43613 4/20 0.36
HCRTR2 O43614 4/20 0.36
TSHR P16473 1/20 0.36
HRH3 Q9Y5N1 1/20 0.35
PDE2A O00408 1/20 0.35
CHRM2 P08172 1/20 0.35
CHRM5 P08912 1/20 0.35
CHRM1 P11229 1/20 0.35
CHRM3 P20309 1/20 0.35
LIPE Q05469 1/20 0.34
ROS1 P08922 1/20 0.34
ALK Q9UM73 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
SCHEMBL2022488 0.87 GRM2 (0.51) GRM2ALDH1A1HCRTR1HCRTR2TSHR
SCHEMBL2028589 0.87 GRM2 (0.53) GRM2ALDH1A1HCRTR1HCRTR2TSHR
SCHEMBL2028720 0.84 GRM2 (0.53) GRM2ALDH1A1CHRM4HCRTR1HCRTR2
SCHEMBL2027356 0.83 GRM2 (0.51) GRM2ALDH1A1CHRM4TSHRHRH3
SCHEMBL2022288 0.82 GRM2 (0.47) GRM2ALDH1A1CHRM4HCRTR1HCRTR2
SCHEMBL2023300 0.82 GRM2 (0.50) GRM2ALDH1A1CHRM4TSHRHRH3
SCHEMBL2023238 0.81 GRM2 (0.54) GRM2ALDH1A1CHRM4TSHRCHRM5
SCHEMBL2025669 0.81 GRM2 (0.49) GRM2ALDH1A1TSHR
SCHEMBL2025703 0.80 GRM2 (0.50) GRM2ALDH1A1TSHRCHRM5
SCHEMBL8271956 0.80 GRM2 (0.47) GRM2ALDH1A1CHRM4HCRTR1HCRTR2

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 7 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
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 4/4885ALDH1A1 1582/4885CHRM4 90/4885

“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.