SCHEMBL2024508

SCHEMBL2024508

CN1CCC(CCCc2cc(Cl)c3c(c2)CN(Cc2ccc(OC(F)(F)F)cc2)C3=O)CC1

nearest known ligand 0.43

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.43
GRM2 Q14416 2/20 0.42
NMT1 P30419 10/20 0.40
KCNH2 Q12809 1/20 0.38
MOGAT2 Q3SYC2 1/20 0.38
HCRTR1 O43613 4/20 0.38
HCRTR2 O43614 4/20 0.38
HTR2A P28223 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
SCHEMBL2028582 0.91 GRM2 (0.49) ALDH1A1GRM2NMT1MOGAT2HCRTR1
SCHEMBL2027732 0.90 ALDH1A1 (0.45) ALDH1A1GRM2HCRTR1HCRTR2HTR2A
SCHEMBL2023163 0.89 GRM2 (0.46) GRM2NMT1HCRTR1HCRTR2
SCHEMBL2024352 0.88 KCNH2 (0.43) KCNH2
SCHEMBL2021597 0.87 ALDH1A1 (0.52) ALDH1A1GRM2NMT1
SCHEMBL2025437 0.84 GRM2 (0.47) ALDH1A1GRM2HCRTR1HCRTR2
SCHEMBL2022620 0.83 GRM2 (0.43) ALDH1A1GRM2HCRTR1HCRTR2
SCHEMBL2026888 0.83 GRM2 (0.47) ALDH1A1GRM2HCRTR1HCRTR2
SCHEMBL2023985 0.81 GRM2 (0.54) ALDH1A1GRM2NMT1HCRTR1HCRTR2
SCHEMBL2022161 0.81 GRM2 (0.51) ALDH1A1GRM2HCRTR1HCRTR2HTR2A

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 8 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

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 ALDH1A1 1582/4885GRM2 4/4885NMT1 1347/4885

“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.