SCHEMBL8744784

SCHEMBL8744784

COC(=O)CNC(=O)Cc1c(C)cc(C)cc1C

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.50
RECQL P46063 1/20 0.46
GAA P10253 3/20 0.41
KDM4E B2RXH2 1/20 0.41
PTGS2 P35354 1/20 0.41
DPP4 P27487 1/20 0.41
NLRP3 Q96P20 1/20 0.39
TET2 Q6N021 1/20 0.39
MAPT P10636 2/20 0.38
MEN1 O00255 1/20 0.38
LMNA P02545 1/20 0.38
HTT P42858 1/20 0.38
KMT2A Q03164 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
P2RX7 Q99572 2/20 0.37
VEGFA P15692 1/20 0.37
FLT1 P17948 1/20 0.37
EGLN1 Q9GZT9 1/20 0.37
EGLN3 Q9H6Z9 1/20 0.37
ALDH1A1 P00352 1/20 0.37

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
SCHEMBL769278 0.82 GAA (0.48) SMN1; SMN2GAAKDM4ENLRP3MAPT
SCHEMBL4241666 0.79 HPGD (0.42) MAPTMEN1LMNAKMT2AP2RX7
SCHEMBL8874347 0.74 HTT (0.39) SMN1; SMN2NLRP3HTTNPSR1P2RX7
SCHEMBL9593911 0.73 HPGD (0.36) SMN1; SMN2NLRP3MAPTMEN1LMNA
SCHEMBL8090802 0.73 MAPT (0.36) SMN1; SMN2GAAKDM4ENLRP3MAPT
SCHEMBL8873539 0.73 TAS1R3 (0.41) GAAKDM4EPTGS2NLRP3MEN1
SCHEMBL8874342 0.72 HPGD (0.38) SMN1; SMN2KDM4ENLRP3MAPTMEN1
SCHEMBL15516425 0.72 NLRP3 (0.46) GAAKDM4ENLRP3MAPTMEN1
SCHEMBL7642729 0.72 MAPT (0.37) SMN1; SMN2KDM4ENLRP3MAPTMEN1
SCHEMBL6921814 0.71 ALDH1A1 (0.45) SMN1; SMN2GAAKDM4EMAPTMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0456063-B1 1-H-3-aryl-pyrrolidin-2,4-dion-derivatives BAYER AG (DE) 1997-01-22 EP disclosed
US-5258527-A Insecticidal, acaricidal and herbicidal 1-H-3-aryl-pyrrolidine-2,4-dione derivatives BAYER AKTIENGESELLSCHAFT (DE) 1993-11-02 US disclosed
EP-0456063-A2 1-H-3-aryl-pyrrolidin-2,4-dion-derivatives BAYER AG (DE) 1991-11-13 EP disclosed