SCHEMBL4340969

SCHEMBL4340969

Cn1c(CN2CCN(c3cccc(Cl)c3Cl)CC2)c(Cl)c(=O)n1-c1ccccc1

nearest known ligand 0.60

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 16/20 0.60
DRD3 P35462 14/20 0.60
DRD4 P21917 7/20 0.60
SMN1; SMN2 Q16637 1/20 0.56
KDM4E B2RXH2 1/20 0.49
ALDH1A1 P00352 1/20 0.49
HTR2A P28223 2/20 0.48
DRD5 P21918 1/20 0.48
HTR1A P08908 2/20 0.47
HTR7 P34969 1/20 0.47
HTR6 P50406 1/20 0.47
OPRM1 P35372 1/20 0.47

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
SCHEMBL4332484 0.94 SMN1; SMN2 (0.56) DRD2DRD3DRD4SMN1; SMN2KDM4E
SCHEMBL4332295 0.89 SMN1; SMN2 (0.53) DRD2DRD3DRD4SMN1; SMN2KDM4E
SCHEMBL4318261 0.89 SMN1; SMN2 (0.62) DRD2DRD3DRD4SMN1; SMN2KDM4E
SCHEMBL4320070 0.88 ALDH1A1 (0.56) DRD2DRD4SMN1; SMN2KDM4EALDH1A1
SCHEMBL4320868 0.88 SMN1; SMN2 (0.53) DRD2DRD3DRD4SMN1; SMN2KDM4E
SCHEMBL4326777 0.88 SMN1; SMN2 (0.74) DRD2DRD3DRD4SMN1; SMN2KDM4E
SCHEMBL4318788 0.88 SMN1; SMN2 (0.53) DRD2DRD3DRD4SMN1; SMN2KDM4E
SCHEMBL8257040 0.88 SMN1; SMN2 (0.53) DRD2DRD3DRD4SMN1; SMN2KDM4E
SCHEMBL4326325 0.87 ADRA1D (0.50) DRD2DRD3DRD4SMN1; SMN2KDM4E
SCHEMBL4324444 0.87 DRD2 (0.57) DRD2DRD3DRD4SMN1; SMN2KDM4E

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-20090069340-A1 Pyrazolone Compounds As Metabotropic Glutamate Receptor Agonists For The Treatment Of Neurological And Psychiatric Disorders ASTRAZENECA AB (SE) 2009-03-12 US disclosed
US-20090069340-A1 Pyrazolone Compounds As Metabotropic Glutamate Receptor Agonists For The Treatment Of Neurological And Psychiatric Disorders ASTRAZENECA AB (SE) 2009-03-12 US disclosed
US-20090069340-A1 Pyrazolone Compounds As Metabotropic Glutamate Receptor Agonists For The Treatment Of Neurological And Psychiatric Disorders ASTRAZENECA AB (SE) 2009-03-12 US disclosed
EP-1833800-A1 PYRAZOLONE COMPOUNDS AS METABOTROPIC GLUTAMATE RECEPTOR AGONISTS FOR THE TREATMENT OF NEUROLOGICAL AND PSYCHIATRIC DISORDERS AstraZeneca AB (SE) 2007-09-19 EP disclosed
WO-2006071730-A1 PYRAZOLONE COMPOUNDS AS METABOTROPIC GLUTAMATE RECEPTOR AGONISTS FOR THE TREATMENT OF NEUROLOGICAL AND PSYCHIATRIC DISORDERS ASTRAZENECA AB (SE) 2006-07-06 WO disclosed
WO-2006071730-A1 PYRAZOLONE COMPOUNDS AS METABOTROPIC GLUTAMATE RECEPTOR AGONISTS FOR THE TREATMENT OF NEUROLOGICAL AND PSYCHIATRIC DISORDERS ASTRAZENECA AB (SE) 2006-07-06 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-20090069340-A1 Pyrazolone Compounds As Metabotropic Glutamate Receptor Agonists For The Treatment Of Neurological And Psychiatric Disorders GRIN1, GRM1, GRIN3A DRD2 121/4885DRD3 155/4885DRD4 241/4885

“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.