SCHEMBL8557083

SCHEMBL8557083

COC(=O)[C@H](C)NC(=O)Cc1ccc(C)cc1Cl

nearest known ligand 0.48

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.46
RECQL P46063 3/20 0.45
MEN1 O00255 3/20 0.43
KMT2A Q03164 3/20 0.43
LMNA P02545 1/20 0.43
PTGS2 P35354 2/20 0.43
ALDH1A1 P00352 4/20 0.41
L3MBTL1 Q9Y468 2/20 0.41
HTT P42858 2/20 0.41
THRB P10828 1/20 0.41
MAPT P10636 1/20 0.41
TSHR P16473 2/20 0.40
NPC1 O15118 1/20 0.39
RAB9A P51151 1/20 0.39
LPAR1 Q92633 1/20 0.39

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
SCHEMBL8656928 1.00 GAA (0.46) GAARECQLMEN1KMT2ALMNA
SCHEMBL8657346 0.87 ALDH1A1 (0.51) GAAMEN1KMT2ALMNAALDH1A1
SCHEMBL8556625 0.87 ALDH1A1 (0.51) GAAMEN1KMT2ALMNAALDH1A1
SCHEMBL4432499 0.86 PTGS2 (0.50) GAARECQLMEN1KMT2APTGS2
SCHEMBL6481400 0.86 PTGS2 (0.50) GAARECQLMEN1KMT2APTGS2
SCHEMBL8553756 0.86 KDM4E (0.45) GAAMEN1KMT2APTGS2ALDH1A1
SCHEMBL8553759 0.86 KDM4E (0.45) GAAMEN1KMT2APTGS2ALDH1A1
SCHEMBL8555232 0.86 TAS1R3 (0.52) ALDH1A1
SCHEMBL8651617 0.86 TAS1R3 (0.52) ALDH1A1
SCHEMBL8553227 0.85 ALDH1A1 (0.55) ALDH1A1HTTMAPT

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
CN-1080719-C Substituted 1H-3-aryl-pyrrolidine-2,4-diones derivative BAYER GMBH (DE) 2002-03-13 CN disclosed
US-5847211-A Substituted 1H-3-Aryl-pyrrolidine-2,4-dione derivatives BAYER AKTIENGESELLSCHAFT (DE) 1998-12-08 US disclosed
EP-0668267-B1 Substituted 1H-3-aryl-pyrrolidine-2,4-dione derivatives BAYER AG (DE) 1998-04-08 EP disclosed
US-5622917-A PESTICIDES BAYER AKTIENGESELLSCHAFT (DE) 1997-04-22 US disclosed
CN-1110680-A Substituted 1H-3-aryl-pyrrolidine-2,4-diones derivative BYLL GMBH (DE) 1995-10-25 CN disclosed
EP-0668267-A1 Substituted 1H-3-aryl-pyrrolidine-2,4-dione derivatives BAYER AG (DE) 1995-08-23 EP disclosed