SCHEMBL8272003

SCHEMBL8272003

CCC1C=CC(CN2Cc3cc(-c4ccc(N5CCOCC5)nc4)cc(C)c3C2=O)=CC1

nearest known ligand 0.38

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
GRM2 Q14416 1/20 0.38
CHRM1 P11229 1/20 0.37
CNR2 P34972 4/20 0.37
ERN1 O75460 2/20 0.36
CYP11B2 P19099 1/20 0.36
GPR84 Q9NQS5 1/20 0.35
SYK P43405 2/20 0.34
FGFR1 P11362 1/20 0.34
FGFR4 P22455 1/20 0.34
PIK3CG P48736 1/20 0.34
CYP3A4 P08684 1/20 0.33
PDE4B Q07343 1/20 0.33
PDE7A Q13946 1/20 0.33
PDE7B Q9NP56 1/20 0.33
AOC3 Q16853 1/20 0.33
P2RX7 Q99572 1/20 0.33

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
SCHEMBL8271898 0.83 TNKS (0.38) GRM2CNR2FGFR1PIK3CG
SCHEMBL2026656 0.81 CHRM1 (0.47) GRM2CHRM1CNR2ERN1CYP11B2
SCHEMBL2024043 0.73 TNKS (0.41) GRM2CHRM1FGFR1PIK3CG
SCHEMBL2026458 0.71 TNKS (0.43) CNR2PIK3CG
SCHEMBL2023271 0.67 GRM2 (0.54) GRM2FGFR1PIK3CG
SCHEMBL2026378 0.64 ALK (0.44) GRM2CHRM1CNR2FGFR1PIK3CG
SCHEMBL2021690 0.64 GRM2 (0.58) GRM2PIK3CG
SCHEMBL2027009 0.63 PIK3CG (0.55) PIK3CGCYP3A4
SCHEMBL12443074 0.63 PIK3CG (0.55) PIK3CGCYP3A4
SCHEMBL2024082 0.61 TNKS (0.43) GRM2CNR2FGFR1PIK3CG

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2006020879-A1 ISOINDOLONE COMPOUNDS AND THEIR USE AS METABOTROPIC GLUTAMATE RECEPTOR POTENTIATORS ASTRAZENECA AB (SE) 2006-02-23 WO disclosed