SCHEMBL2027732

SCHEMBL2027732

CN1CCC(Cc2cc(Cl)c3c(c2)CN(Cc2ccc(OC(F)(F)F)cc2)C3=O)CC1

nearest known ligand 0.45

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.45
GRM2 Q14416 3/20 0.44
HTR2A P28223 1/20 0.39
HCRTR1 O43613 7/20 0.39
HCRTR2 O43614 7/20 0.39
CCR2 P41597 1/20 0.39
TSHR P16473 1/20 0.38
CCR5 P51681 1/20 0.37
CHRM4 P08173 1/20 0.36
CHRM5 P08912 1/20 0.36
GRIN2B Q13224 1/20 0.36

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
SCHEMBL2022161 0.91 GRM2 (0.51) ALDH1A1GRM2HTR2AHCRTR1HCRTR2
SCHEMBL2024508 0.90 ALDH1A1 (0.43) ALDH1A1GRM2HTR2AHCRTR1HCRTR2
SCHEMBL1003992 0.89 GRM2 (0.47) ALDH1A1GRM2HCRTR1HCRTR2CHRM5
SCHEMBL27704067 0.88 GRM2 (0.40) ALDH1A1GRM2HCRTR1HCRTR2CCR2
SCHEMBL2020644 0.88 GRM2 (0.44) ALDH1A1GRM2CCR2TSHRCHRM4
SCHEMBL2025072 0.87 KCNH2 (0.44) GRM2CCR5CHRM4
SCHEMBL8271209 0.86 GRM2 (0.39) ALDH1A1GRM2HCRTR1HCRTR2CCR2
SCHEMBL1001844 0.86 GRM2 (0.43) ALDH1A1GRM2CCR2TSHRCHRM4
SCHEMBL2028165 0.86 LMNA (0.39) ALDH1A1
SCHEMBL2025301 0.86 FPR2 (0.42) ALDH1A1

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
US-20090275578-A1 Isoindolone compounds and their use as metabotropic glutamate receptor potentiators ASTRAZENECA AB (SE) 2009-11-05 US claimed
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 4/4885HTR2A 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.