SCHEMBL6827562

SCHEMBL6827562

COc1ccc(C2CC(=O)NC(=O)N2)cc1

nearest known ligand 0.51

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
DDB1 Q16531 1/20 0.51
CRBN Q96SW2 1/20 0.51
KDM4E B2RXH2 4/20 0.50
ALDH1A1 P00352 3/20 0.50
TP53 P04637 1/20 0.50
GAA P10253 4/20 0.47
TSHR P16473 1/20 0.47
MAP2K1 Q02750 1/20 0.44
MAPT P10636 1/20 0.44
HPGD P15428 1/20 0.44
CASP1 P29466 1/20 0.44
MPI P34949 1/20 0.44
HSD17B10 Q99714 1/20 0.44
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41

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
SCHEMBL1499046 0.80 TP53 (0.41) ALDH1A1TP53GAAMAPTHSD17B10
SCHEMBL1499025 0.78 TDP1 (0.56) KDM4EALDH1A1TP53GAAMAPT
SCHEMBL6827556 0.78 PDE4A (0.44) KDM4EGAAHSD17B10
SCHEMBL1499114 0.78 DDB1 (0.44) DDB1CRBNKDM4EALDH1A1TSHR
SCHEMBL1498959 0.78 DDB1 (0.44) DDB1CRBNKDM4EALDH1A1TSHR
SCHEMBL2200068 0.77 KDM4E (0.46) DDB1CRBNKDM4EALDH1A1TP53
SCHEMBL14492202 0.76 ALDH1A1 (0.55) DDB1CRBNKDM4EALDH1A1GAA
SCHEMBL7167696 0.75 ALDH1A1 (0.67) DDB1CRBNKDM4EALDH1A1TP53
SCHEMBL7046333 0.74 TNKS2 (0.57) DDB1CRBNKDM4EALDH1A1TP53
SCHEMBL3657517 0.73 CRBN (0.58) DDB1CRBNKDM4EALDH1A1TP53

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-2004009559-A2 DIHYDROURACIL COMPOUNDS AS ANTI-ICTOGENIC OR ANTI-EPILEPTOGENIC AGENTS QUEEN'S UNIVERSITY AT KINGSTON (CA) 2004-01-29 WO disclosed