SCHEMBL2029501

SCHEMBL2029501

O=C(O)N1CCC(CN2Cc3cc(Cl)ccc3C2=O)CC1

nearest known ligand 0.44

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
HTR1A P08908 1/20 0.43
HTR2A P28223 1/20 0.43
TMEM97 Q5BJF2 1/20 0.43
GRM5 P41594 2/20 0.41
PARP1 P09874 1/20 0.41
PRMT5 O14744 1/20 0.40
WDR77 Q9BQA1 1/20 0.40
HSD11B1 P28845 4/20 0.40
HSD11B2 P80365 2/20 0.39
ADAM17 P78536 1/20 0.39
SDCBP O00560 1/20 0.39
SDC2 P34741 1/20 0.39
THRB P10828 2/20 0.39
MAPT P10636 3/20 0.39
LMNA P02545 1/20 0.39
ACHE P22303 1/20 0.38
TP53 P04637 1/20 0.37

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
SCHEMBL5242210 0.86 HTR1A (0.43) HTR1AHTR2ATMEM97GRM5PARP1
SCHEMBL5243199 0.86 HTR1A (0.53) HTR1AHTR2ATMEM97GRM5PARP1
SCHEMBL5240742 0.83 ADAM17 (0.45) HTR1AHTR2ATMEM97PRMT5WDR77
SCHEMBL5240763 0.83 GRM5 (0.48) HTR1AHTR2ATMEM97GRM5PARP1
SCHEMBL5250167 0.83 HTR1A (0.60) HTR1AHTR2ATMEM97GRM5PARP1
SCHEMBL2023236 0.80 DRD2 (0.50) HTR2AGRM5PARP1PRMT5WDR77
Hydrochloric Acid SCHEMBL5247769 0.79 DRD2 (0.49) HTR2AGRM5PARP1PRMT5WDR77
SCHEMBL5250640 0.79 HTR1A (0.53) HTR1AHTR2ATMEM97PARP1ADAM17
SCHEMBL5251364 0.79 HTR1A (0.43) HTR1AHTR2ATMEM97GRM5PARP1
SCHEMBL5248887 0.78 HTR2A (0.75) HTR1AHTR2ATMEM97ADAM17MAPT

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 10 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-1778634-A1 ISOINDOLONE COMPOUNDS AND THEIR USE AS METABOTROPIC GLUTAMATE RECEPTOR POTENTIATORS AstraZeneca AB (SE) 2007-05-02 EP claimed
WO-2006020879-A1 ISOINDOLONE COMPOUNDS AND THEIR USE AS METABOTROPIC GLUTAMATE RECEPTOR POTENTIATORS ASTRAZENECA AB (SE) 2006-02-23 WO 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-1260512-B1 NOVEL CYCLIC AMIDE DERIVATIVES MITSUBISHI PHARMA CORP (JP) 2007-07-04 EP disclosed
US-7166617-B2 Cyclic amide derivatives MITSUBISHI PHARMA CORPORATION (JP) 2007-01-23 US disclosed
US-20030212094-A1 Novel cyclic amide derivatives MITSUBISHI PHARMA CORPORATION (JP) 2003-11-13 US disclosed
EP-1260512-A1 NOVEL CYCLIC AMIDE DERIVATIVES Mitsubishi Pharma Corporation (JP) 2002-11-27 EP 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 (2 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 HTR1A 333/4885HTR2A 701/4885TMEM97 786/4885
US-20030212094-A1 Novel cyclic amide derivatives SIGMAR1, OPRM1, OPRD1 HTR1A 79/4885HTR2A 153/4885TMEM97 10/4885

“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.