SCHEMBL27554268

SCHEMBL27554268

O=C(O)c1cccc(CNC(=S)Nc2ccc(NC(=O)c3csnn3)cc2)c1

nearest known ligand 0.57

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 2/20 0.57
MAPT P10636 7/20 0.52
MEN1 O00255 4/20 0.52
KMT2A Q03164 4/20 0.52
ALDH1A1 P00352 4/20 0.52
CYP19A1 P11511 2/20 0.49
LMNA P02545 1/20 0.49
TP53 P04637 3/20 0.47
THRB P10828 2/20 0.47
NPC1 O15118 1/20 0.46
POLB P06746 1/20 0.46
HPGD P15428 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
HIF1A Q16665 1/20 0.46
HDAC1 Q13547 2/20 0.46
NPSR1 Q6W5P4 1/20 0.44

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
SCHEMBL6816140 0.88 MAPT (0.63) RAB9AMAPTMEN1KMT2AALDH1A1
SCHEMBL6816922 0.87 THRB (0.61) RAB9AMAPTMEN1KMT2AALDH1A1
SCHEMBL6814879 0.86 MAPT (0.50) RAB9AMAPTMEN1KMT2AALDH1A1
SCHEMBL6816400 0.86 HDAC1 (0.56) RAB9AMAPTMEN1KMT2AALDH1A1
SCHEMBL6815844 0.84 MEN1 (0.63) MAPTMEN1KMT2AALDH1A1CYP19A1
SCHEMBL6816509 0.83 LMNA (0.51) RAB9AMAPTMEN1KMT2AALDH1A1
SCHEMBL6814900 0.83 THRB (0.54) RAB9AMAPTMEN1KMT2AALDH1A1
SCHEMBL6819815 0.82 MAPT (0.50) RAB9AMAPTMEN1KMT2AALDH1A1
SCHEMBL6819280 0.82 LMNA (0.52) RAB9AMAPTMEN1KMT2AALDH1A1
SCHEMBL6815723 0.82 LMNA (0.55) RAB9AMAPTMEN1KMT2AALDH1A1

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