SCHEMBL8650400

SCHEMBL8650400

CC1NC(=O)C(c2ccc(Cl)cc2Cl)C1=O

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 3/20 0.54
ALDH1A1 P00352 6/20 0.40
KDM4E B2RXH2 4/20 0.40
HPGD P15428 3/20 0.40
CASP1 P29466 1/20 0.40
CASP7 P55210 1/20 0.40
HSD17B10 Q99714 1/20 0.40
HTT P42858 4/20 0.39
LMNA P02545 2/20 0.39
CYP1A2 P05177 1/20 0.39
CYP2D6 P10635 1/20 0.39
CYP2C9 P11712 1/20 0.39
ALOX15 P16050 1/20 0.39
ALOX12 P18054 1/20 0.39
CYP2C19 P33261 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
MAPK1 P28482 1/20 0.39
TP53 P04637 1/20 0.38
KMT2A Q03164 2/20 0.38
MEN1 O00255 1/20 0.38

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
SCHEMBL8557122 0.86 GAA (0.42) GAAALDH1A1HPGDLMNACYP1A2
SCHEMBL4433341 0.82 GAA (0.40) GAAALDH1A1KDM4EHPGDKMT2A
SCHEMBL812401 0.81 PGR (0.40) GAAALDH1A1CASP1HTTSMN1; SMN2
SCHEMBL6207998 0.72 ALDH1A1 (0.49) GAAALDH1A1KDM4EHPGDCASP1
SCHEMBL812403 0.72 SMN1; SMN2 (0.43) GAAALDH1A1KDM4EHPGDHSD17B10
SCHEMBL812402 0.72 PGR (0.49) ALDH1A1HPGDMAPTTSHRPGR
SCHEMBL6207995 0.72 PGR (0.40) GAAALDH1A1KDM4EHPGDCASP1
SCHEMBL7098246 0.70 ALDH1A1 (0.38) GAAALDH1A1HPGDLMNAALOX12
SCHEMBL10752583 0.70 GAA (1.00) GAAALDH1A1KDM4EHPGDHTT
SCHEMBL9595577 0.69 ALDH1A1 (0.40) GAAALDH1A1KDM4EHPGDHTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0521334-B1 Substituted 1-H-3-aryl-pyrrolidin-2,4-dione derivatives, their preparation and their use as insecticides, acaricides and herbicides BAYER AG (DE) 1998-09-09 EP disclosed
US-5616536-A INSECTICIDES, MITICIDES, HERBICIDES BAYER AKTIENGESELLSCHAFT (DE) 1997-04-01 US disclosed
EP-0456063-B1 1-H-3-aryl-pyrrolidin-2,4-dion-derivatives BAYER AG (DE) 1997-01-22 EP disclosed
US-5589469-A INSECTICIDES, MITICIDES OR HERBICIDES BAYER AKTIENGESELLSCHAFT (DE) 1996-12-31 US disclosed
EP-0521334-A1 Substituted 1-H-3-aryl-pyrrolidin-2,4-dione derivatives BAYER AG (DE) 1993-01-07 EP disclosed