SCHEMBL2023588

SCHEMBL2023588

O=C1c2c(Cl)cc(C(Cc3ccncc3)C3CCNCC3)cc2CN1CC1CC1

nearest known ligand 0.39

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
PARP1 P09874 2/20 0.39
SLC6A4 P31645 17/20 0.36
SLC6A2 P23975 14/20 0.36
SLC6A3 Q01959 14/20 0.36
DRD2 P14416 1/20 0.32

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
SCHEMBL2020458 0.87 SLC6A4 (0.36) SLC6A4SLC6A2SLC6A3
SCHEMBL2020646 0.83 GRM2 (0.43) SLC6A4SLC6A2SLC6A3
SCHEMBL2024501 0.80 SLC6A2 (0.46) PARP1SLC6A4SLC6A2SLC6A3DRD2
SCHEMBL1002132 0.78 PARP1 (0.39) PARP1SLC6A4SLC6A2SLC6A3
SCHEMBL1001900 0.77 PARP1 (0.38) PARP1SLC6A4SLC6A2SLC6A3
SCHEMBL2025786 0.74 SLC6A4 (0.36) SLC6A4SLC6A2SLC6A3
SCHEMBL1003211 0.74 PARP1 (0.41) PARP1SLC6A2SLC6A3
SCHEMBL1005065 0.74 PARP1 (0.37) PARP1
SCHEMBL2023783 0.74 GRM2 (0.51) SLC6A4SLC6A2SLC6A3
SCHEMBL5243321 0.73 PARP1 (0.39) PARP1DRD2

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 6 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
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
EP-1778634-A1 ISOINDOLONE COMPOUNDS AND THEIR USE AS METABOTROPIC GLUTAMATE RECEPTOR POTENTIATORS AstraZeneca AB (SE) 2007-05-02 EP 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 PARP1 3945/4885SLC6A4 465/4885SLC6A2 835/4885

“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.