SCHEMBL27404604

SCHEMBL27404604

O=C1CN(Sc2ccc(-c3ccccc3)cc2)C(=O)N1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 2/20 0.39
ALDH1A1 P00352 1/20 0.38
MAPT P10636 1/20 0.38
HSD17B10 Q99714 1/20 0.38
TDP2 O95551 1/20 0.37
FAAH O00519 1/20 0.37
MGLL Q99685 1/20 0.37
DDB1 Q16531 2/20 0.34
CRBN Q96SW2 2/20 0.34
MCL1 Q07820 1/20 0.34
BRD4 O60885 3/20 0.33
GLO1 Q04760 1/20 0.33
CHEK1 O14757 1/20 0.33
AURKA O14965 1/20 0.33
DAPK3 O43293 1/20 0.33
PRKD3 O94806 1/20 0.33
MAP4K4 O95819 1/20 0.33
ABL1 P00519 1/20 0.33
NTRK1 P04629 1/20 0.33
CSF1R P07333 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
Benzene SCHEMBL27623239 0.90 MAPT (0.46) PTGS2ALDH1A1MAPTHSD17B10DDB1
SCHEMBL62940 0.90 MAPT (0.46) PTGS2ALDH1A1MAPTHSD17B10DDB1
Alanine SCHEMBL6904183 0.76 ALDH1A1 (0.36) ALDH1A1MAPTHSD17B10MAOAMAOB
SCHEMBL9864475 0.72 MAPT (0.38) ALDH1A1MAPTHSD17B10MGLLDDB1
SCHEMBL9701179 0.71 TDP2 (0.35) ALDH1A1MAPTHSD17B10TDP2MGLL
SCHEMBL22498758 0.68 CRBN (0.35) ALDH1A1MAPTDDB1CRBNCHEK1
SCHEMBL9751662 0.68 CRBN (0.35) ALDH1A1MAPTHSD17B10DDB1CRBN
SCHEMBL2001787 0.67 ENPP2 (0.57) FAAHMGLLDDB1CRBNEPHX2
SCHEMBL9751620 0.67 CRBN (0.43) ALDH1A1MAPTHSD17B10DDB1CRBN
Biphenyl SCHEMBL7154019 0.63 CRBN (0.58) ALDH1A1MAPTHSD17B10TDP2DDB1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101863834-B Preparation method of S-carboxymethyl-5,5-diphenyl-2-thiohydantoin UNIV BOHAI 2012-10-10 CN claimed
CN-101863835-B Synthesis method of S-substituted-5,5-diphenyl-2-thiohydantoin derivatives UNIV BOHAI 2012-10-10 CN claimed
CN-101863836-B Method for preparing 5,5-diphenyl-2-thiohydantoin UNIV BOHAI 2012-10-10 CN claimed
CN-101863835-A Synthesis method of S-substituted-5,5-diphenyl-2-thiohydantoin derivatives UNIV BOHAI 2010-10-20 CN claimed
CN-101863834-A Preparation method of S-carboxymethyl-5,5-diphenyl-2-thiohydantoin UNIV BOHAI 2010-10-20 CN claimed
CN-101863836-A Method for preparing 5,5-diphenyl-2-thiohydantoin UNIV BOHAI 2010-10-20 CN claimed
CN-101863834-B Preparation method of S-carboxymethyl-5,5-diphenyl-2-thiohydantoin UNIV BOHAI 2012-10-10 CN disclosed
CN-101863835-B Synthesis method of S-substituted-5,5-diphenyl-2-thiohydantoin derivatives UNIV BOHAI 2012-10-10 CN disclosed
CN-101863836-B Method for preparing 5,5-diphenyl-2-thiohydantoin UNIV BOHAI 2012-10-10 CN disclosed
CN-101863835-A Synthesis method of S-substituted-5,5-diphenyl-2-thiohydantoin derivatives UNIV BOHAI 2010-10-20 CN disclosed
CN-101863834-A Preparation method of S-carboxymethyl-5,5-diphenyl-2-thiohydantoin UNIV BOHAI 2010-10-20 CN disclosed
CN-101863836-A Method for preparing 5,5-diphenyl-2-thiohydantoin UNIV BOHAI 2010-10-20 CN disclosed
CN-1074215-A Mycocidal 2-tetrahydroglyoxaline-5-ketone and 2-tetrahydroglyoxaline-5-40 thione derivatives RHONE POULENC AGROCHIMIE (FR) 1993-07-14 CN disclosed