SCHEMBL8288352

SCHEMBL8288352

CCOC(=O)c1c(-c2ccc(-c3ccccc3F)cc2)c(C#N)c(Cl)n1C

nearest known ligand 0.59

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
GRIA4 P48058 15/20 0.59
GRIA2 P42262 13/20 0.59
ALDH1A1 P00352 4/20 0.42
KDM4E B2RXH2 2/20 0.42
HPGD P15428 1/20 0.42
LMNA P02545 1/20 0.41
KMT2A Q03164 1/20 0.41
HTT P42858 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
RXFP1 Q9HBX9 1/20 0.40
SMN1; SMN2 Q16637 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
SCHEMBL8287321 0.90 GRIA4 (0.59) GRIA4GRIA2ALDH1A1KDM4EHTT
SCHEMBL8288356 0.90 GRIA4 (0.60) GRIA4GRIA2ALDH1A1KDM4EHPGD
SCHEMBL8288360 0.89 GRIA4 (0.59) GRIA4GRIA2ALDH1A1KDM4EHPGD
SCHEMBL8288318 0.88 GRIA4 (0.77) GRIA4GRIA2
SCHEMBL8288354 0.87 GRIA4 (0.56) GRIA4GRIA2ALDH1A1KDM4EHPGD
SCHEMBL8289591 0.85 GRIA4 (0.72) GRIA4GRIA2
SCHEMBL4372491 0.81 GRIA4 (0.61) GRIA4GRIA2ALDH1A1KDM4EHPGD
SCHEMBL8288396 0.80 GRIA4 (0.59) GRIA4GRIA2ALDH1A1KDM4EHPGD
SCHEMBL8289793 0.80 GRIA2 (0.77) GRIA4GRIA2ALDH1A1KDM4EHPGD
SCHEMBL8289331 0.79 GRIA2 (0.51) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1670757-B1 PYRROLE AND PYRAZOLE DERIVATIVES AS POTENTIATORS OF GLUTAMATE RECEPTORS LILLY CO ELI (US) 2009-05-06 EP disclosed
WO-2005040110-A1 PYRROLE AND PYRAZOLE DERIVATIVES AS POTENTIATORS OF GLUTAMATE RECEPTORS ELI LILLY AND COMPANY (US) 2005-05-06 WO disclosed