SCHEMBL4319935

SCHEMBL4319935

Cc1ccc(C)c(N2CCN(Cc3c(Cl)c(=O)n(-c4ccccc4)n3C)CC2)c1

nearest known ligand 0.53

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.53
MEN1 O00255 1/20 0.49
KMT2A Q03164 1/20 0.49
LMNA P02545 1/20 0.46
MAPT P10636 4/20 0.46
GAA P10253 1/20 0.46
ALDH1A1 P00352 1/20 0.46
ADRA1A P35348 2/20 0.44
ADRA1B P35368 2/20 0.44
DRD4 P21917 1/20 0.44
HTR1A P08908 1/20 0.44
TP53 P04637 4/20 0.43
HTR7 P34969 1/20 0.43
NPSR1 Q6W5P4 1/20 0.43
ADRA1D P25100 1/20 0.42

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
SCHEMBL4319872 0.92 SMN1; SMN2 (0.53) SMN1; SMN2MAPTALDH1A1DRD4HTR1A
SCHEMBL4324667 0.92 SMN1; SMN2 (0.53) SMN1; SMN2MAPTALDH1A1ADRA1AADRA1B
SCHEMBL4318261 0.89 SMN1; SMN2 (0.62) SMN1; SMN2LMNAALDH1A1ADRA1AADRA1B
SCHEMBL4319476 0.86 ALDH1A1 (0.55) SMN1; SMN2MEN1KMT2AMAPTGAA
SCHEMBL4325976 0.86 ALDH1A1 (0.50) SMN1; SMN2LMNAMAPTGAAALDH1A1
SCHEMBL4332484 0.86 SMN1; SMN2 (0.56) SMN1; SMN2LMNAALDH1A1ADRA1AADRA1B
SCHEMBL4327923 0.85 ALDH1A1 (0.52) SMN1; SMN2MAPTALDH1A1DRD4HTR1A
SCHEMBL8259509 0.85 ALDH1A1 (0.52) SMN1; SMN2MEN1KMT2ALMNAMAPT
SCHEMBL4329530 0.85 ALDH1A1 (0.51) SMN1; SMN2MEN1KMT2ALMNAMAPT
SCHEMBL4320070 0.84 ALDH1A1 (0.56) SMN1; SMN2MAPTGAAALDH1A1DRD4

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 SMN1; SMN2 1220/4885MEN1 3300/4885KMT2A 2407/4885

“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.