SCHEMBL27484285

SCHEMBL27484285

CC(C)(Cc1ccc(NC(=O)c2ccccc2F)cc1)OC(N)=O

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 2/20 0.57
MEN1 O00255 2/20 0.57
KMT2A Q03164 2/20 0.57
SMN1; SMN2 Q16637 8/20 0.54
NPC1 O15118 12/20 0.54
RAB9A P51151 12/20 0.54
KDM4E B2RXH2 2/20 0.54
POLB P06746 1/20 0.54
NPSR1 Q6W5P4 1/20 0.54
LMNA P02545 2/20 0.53
MAPT P10636 4/20 0.52
TP53 P04637 3/20 0.52
NFKB1 P19838 1/20 0.52
NFKB2 Q00653 1/20 0.52
RELA Q04206 1/20 0.52
HTT P42858 1/20 0.48
TLR8 Q9NR97 1/20 0.46
ALDH1A1 P00352 2/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
HPGD P15428 1/20 0.46

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
SCHEMBL27484976 0.88 TDP1 (0.55) TDP1MEN1KMT2ASMN1; SMN2NPC1
SCHEMBL27484292 0.86 PTGS1 (0.52) TDP1LMNAMAPT
SCHEMBL27727249 0.83 PPARA (0.53) MEN1KMT2ASMN1; SMN2NPC1RAB9A
SCHEMBL27485010 0.82 KMT2A (0.41) TDP1MEN1KMT2ASMN1; SMN2NPC1
SCHEMBL27485018 0.81 HTT (0.57) MEN1KMT2ASMN1; SMN2KDM4ELMNA
SCHEMBL27469807 0.77 RAB9A (0.56) MEN1KMT2ASMN1; SMN2NPC1RAB9A
SCHEMBL7075705 0.76 MEN1 (0.75) TDP1MEN1KMT2ASMN1; SMN2NPC1
SCHEMBL7079568 0.76 NAMPT (0.57) TDP1MEN1KMT2ASMN1; SMN2NPC1
SCHEMBL27470274 0.76 PTGS1 (0.55) MEN1KMT2ASMN1; SMN2KDM4ENPSR1
SCHEMBL27485059 0.76 ALDH1A1 (0.47) MEN1KMT2ASMN1; SMN2NPC1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1165531-C Alpha-methylbenzyl-containing thiourea inhibitors of herpes viruses containing phenylenediamine groups 2004-09-08 CN disclosed
CN-1367785-A Heterocyclic carboxamide-containing thiourea inhibitors of herpes viruses containing substituted phenylenediamine groups AMERICAN HOME PROD (US) 2002-09-04 CN disclosed
CN-1348446-A Heterocyclic carboxamide-containing thiourea inhibitors of herpes viruses containing phenylenediamine groups AMERICAN HOME PROD (US) 2002-05-08 CN disclosed
CN-1335843-A Thiourea inhibitors of herpes viruses AMERICAN HOME PROD (US) 2002-02-13 CN disclosed
CN-1333769-A Thiourea inhibitors of herps viruses AMERICAN HOME PROD (US) 2002-01-30 CN disclosed
CN-1333750-A Acetamide and substituted acetamide-containing thiourea inhibitors of herpes viruses AMERICAN HOME PROD (US) 2002-01-30 CN disclosed
CN-1332725-A Thiourea inhibitors of herpes viruses AMERICAN HOME PROD (US) 2002-01-23 CN disclosed
CN-1329608-A Alpha-methylbenzyl-containing thioure a inhibitors of herpes viruses containing phenylenediamine group AMERICAN HOME PROD (US) 2002-01-02 CN disclosed