SCHEMBL4372491

SCHEMBL4372491

CCOC(=O)c1c(-c2ccc(-c3ccccc3Cl)cc2)c(C#N)c(C)n1C

nearest known ligand 0.61

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
GRIA4 P48058 14/20 0.61
GRIA2 P42262 13/20 0.61
PIM1 P11309 1/20 0.45
ALDH1A1 P00352 4/20 0.43
KDM4E B2RXH2 2/20 0.43
HPGD P15428 1/20 0.43
LMNA P02545 1/20 0.42
KMT2A Q03164 1/20 0.42
HTT P42858 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
RXFP1 Q9HBX9 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41

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
SCHEMBL8289793 0.90 GRIA2 (0.77) GRIA4GRIA2ALDH1A1KDM4EHPGD
SCHEMBL5485137 0.89 GRIA2 (0.47) GRIA4GRIA2PIM1ALDH1A1KDM4E
SCHEMBL4375364 0.88 GRIA4 (0.61) GRIA4GRIA2ALDH1A1KDM4ELMNA
SCHEMBL4375140 0.87 GRIA4 (0.55) GRIA4GRIA2ALDH1A1KDM4EHPGD
SCHEMBL4378375 0.87 GRIA4 (0.73) GRIA4GRIA2ALDH1A1KDM4EHTT
SCHEMBL8287638 0.85 GRIA4 (0.75) GRIA4GRIA2
SCHEMBL4369403 0.85 GRIA4 (0.63) GRIA4GRIA2ALDH1A1KDM4EKMT2A
SCHEMBL4371152 0.83 GRIA4 (0.56) GRIA4GRIA2ALDH1A1KDM4EHPGD
SCHEMBL8288356 0.83 GRIA4 (0.60) GRIA4GRIA2ALDH1A1KDM4EHPGD
SCHEMBL4376069 0.82 GRIA4 (0.49) GRIA4GRIA2ALDH1A1KDM4EHPGD

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-7625932-B2 Pyrrole and pyrazole derivatives as potentiators of glutamate receptors ELI LILLY AND COMPANY (US) 2009-12-01 US disclosed
US-7625932-B2 Pyrrole and pyrazole derivatives as potentiators of glutamate receptors ELI LILLY AND COMPANY (US) 2009-12-01 US disclosed
EP-1670757-B1 PYRROLE AND PYRAZOLE DERIVATIVES AS POTENTIATORS OF GLUTAMATE RECEPTORS LILLY CO ELI (US) 2009-05-06 EP disclosed
EP-1670757-B1 PYRROLE AND PYRAZOLE DERIVATIVES AS POTENTIATORS OF GLUTAMATE RECEPTORS LILLY CO ELI (US) 2009-05-06 EP disclosed
US-20070066573-A1 Pyrrole and pyrazole derivatives as potentiators of glutamate receptors ELI LILLY AND COMPANY 2007-03-22 US disclosed
WO-2005040110-A1 PYRROLE AND PYRAZOLE DERIVATIVES AS POTENTIATORS OF GLUTAMATE RECEPTORS ELI LILLY AND COMPANY (US) 2005-05-06 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-20070066573-A1 Pyrrole and pyrazole derivatives as potentiators of glutamate receptors GRIN1, GRIN3A, GRIK5 GRIA4 16/4885GRIA2 17/4885PIM1 1082/4885

“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.