SCHEMBL4318702

SCHEMBL4318702

Cc1c(Cl)c(=O)n(-c2ccc(F)cc2)n1C

nearest known ligand 0.51

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.51
MEN1 O00255 2/20 0.51
FPR2 P25090 1/20 0.46
ALOX15 P16050 2/20 0.44
BCHE P06276 2/20 0.44
PTGS2 P35354 1/20 0.44
ALDH1A1 P00352 1/20 0.44
GAA P10253 1/20 0.43
LMNA P02545 2/20 0.42
ADORA3 P0DMS8 1/20 0.42
HTR7 P34969 1/20 0.42
TSHR P16473 2/20 0.41
CYP1A2 P05177 1/20 0.41
THRB P10828 1/20 0.41
NAPRT Q6XQN6 1/20 0.41
RAB9A P51151 1/20 0.40

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
SCHEMBL4320077 0.86 GAA (0.50) KMT2AMEN1FPR2ALOX15BCHE
SCHEMBL8258700 0.86 TSHR (0.48) KMT2AMEN1FPR2ALOX15BCHE
SCHEMBL29993 0.82 ALDH1A1 (0.64) KMT2AMEN1ALOX15BCHEPTGS2
SCHEMBL14949021 0.82 KMT2A (0.54) KMT2AMEN1FPR2ALOX15BCHE
SCHEMBL4322495 0.82 BRD9 (0.45) KMT2AMEN1ALOX15BCHEPTGS2
SCHEMBL4321369 0.82 FPR2 (0.49) KMT2AFPR2ALOX15BCHEPTGS2
SCHEMBL3528653 0.79 KMT2A (0.51) KMT2AMEN1FPR2ALOX15BCHE
SCHEMBL6260574 0.79 BCHE (0.70) KMT2AMEN1FPR2ALOX15BCHE
SCHEMBL8259595 0.79 FPR2 (0.41) KMT2AMEN1FPR2ALDH1A1GAA
SCHEMBL8258475 0.79 ALDH1A1 (0.47) KMT2AMEN1FPR2ALDH1A1LMNA

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 5 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

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 KMT2A 2407/4885MEN1 3300/4885FPR2 902/4885

“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.