SCHEMBL7478083

SCHEMBL7478083

Cc1ccc(C(=O)NC2(c3ccccc3)C(=O)NC(=O)NC2=O)cc1S(N)(=O)=O

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.47
CNR1 P21554 3/20 0.43
TP53 P04637 2/20 0.43
CNR2 P34972 3/20 0.43
KMT2A Q03164 4/20 0.42
MEN1 O00255 3/20 0.42
ALDH1A1 P00352 1/20 0.42
KDM4E B2RXH2 2/20 0.41
LMNA P02545 1/20 0.41
HTT P42858 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
GAA P10253 1/20 0.39
STAT1 P42224 1/20 0.39
RPA1 P27694 1/20 0.39
GFER P55789 1/20 0.39
PTGER4 P35408 1/20 0.39
APAF1 O14727 1/20 0.39
TDP2 O95551 1/20 0.39
NSD2 O96028 1/20 0.39
GALK1 P51570 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
SCHEMBL7643613 0.87 CA1 (0.52) ALDH1A1GAA
SCHEMBL7475852 0.85 KMT2A (0.53) MAPTKMT2AMEN1ALDH1A1KDM4E
SCHEMBL7474409 0.81 MAOA (0.54) MAPTKMT2AMEN1GAASAE1
SCHEMBL7478795 0.78 LMNA (0.45) MAPTKMT2AMEN1ALDH1A1LMNA
SCHEMBL7471334 0.77 SMN1; SMN2 (0.52) MAPTTP53KMT2AMEN1ALDH1A1
SCHEMBL7483158 0.77 MMP9 (0.41) MAPTKMT2AMEN1ALDH1A1KDM4E
SCHEMBL7482004 0.76 ALDH1A1 (0.46) MAPTKMT2AMEN1ALDH1A1KDM4E
SCHEMBL7477845 0.76 MMP9 (0.42) MAPTKMT2AMEN1ALDH1A1KDM4E
SCHEMBL7483118 0.74 NR1H4 (0.44) TP53KMT2AMEN1LMNAMMP9
SCHEMBL7479933 0.74 ALDH1A1 (0.51) MAPTCNR2KMT2AMEN1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6472396-B1 Barbituric acid derivatives, processes for their production and pharmaceutical agents containing these compounds ROCHE DIAGNOSTICS GMBH (DE) 2002-10-29 US claimed
EP-0869947-B1 BARBITURIC ACID DERIVATIVES, PROCESSES FOR THEIR PRODUCTION AND PHARMACEUTICAL AGENTS CONTAINING THESE COMPOUNDS ROCHE DIAGNOSTICS GMBH (DE) 2002-10-23 EP disclosed