SCHEMBL7743937

SCHEMBL7743937

CC(NC(=S)Nc1ccc(NC(=O)c2cscn2)cc1)c1ccc(Cl)c(F)c1

nearest known ligand 0.42

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.42
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
LMNA P02545 1/20 0.42
MAPT P10636 1/20 0.42
GRM1 Q13255 1/20 0.41
GRM4 Q14833 2/20 0.41
GPR139 Q6DWJ6 12/20 0.40
NPC1 O15118 1/20 0.39
ALDH1A1 P00352 1/20 0.39
TP53 P04637 1/20 0.39
HPGD P15428 1/20 0.39
RAB9A P51151 1/20 0.39
SMN1; SMN2 Q16637 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
SCHEMBL7743960 0.92 KMT2A (0.44) POLBMEN1KMT2ALMNAMAPT
SCHEMBL7743318 0.92 MEN1 (0.41) POLBMEN1KMT2ALMNAMAPT
SCHEMBL7743904 0.91 ALDH1A1 (0.46) POLBMEN1KMT2ALMNAMAPT
SCHEMBL7080554 0.91 MAPK1 (0.41) GPR139NPC1ALDH1A1TP53RAB9A
SCHEMBL7743324 0.88 GRM4 (0.47) POLBMEN1KMT2ALMNAMAPT
SCHEMBL7745943 0.88 PDE2A (0.46) MEN1KMT2AGRM4
SCHEMBL7743331 0.86 GRM4 (0.47) POLBMEN1KMT2ALMNAMAPT
SCHEMBL7743472 0.85 BAZ1A (0.45) POLBMEN1KMT2ALMNAMAPT
SCHEMBL7132908 0.85 GPR139 (0.42) GPR139
SCHEMBL7743468 0.84 GRM4 (0.41) POLBMEN1KMT2ALMNAMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1348446-A Heterocyclic carboxamide-containing thiourea inhibitors of herpes viruses containing phenylenediamine groups AMERICAN HOME PROD (US) 2002-05-08 CN claimed
US-6197803-B1 VIRICIDES; PREVENTION REPRODUCTION AMERICAN HOME PRODUCTS CORPORATION 2001-03-06 US claimed
EP-1144397-A3 HETEROCYCLIC CARBOXAMIDE-CONTAINING THIOUREA INHIBITORS OF HERPES VIRUSES CONTAINING PHENYLENEDIAMINE GROUP Wyeth (US) 2002-09-11 EP disclosed
US-6426355-B1 VIRICIDES; PREVENTION PRODUCTION AMERICAN HOME PRODUCTS 2002-07-30 US disclosed
CN-1348446-A Heterocyclic carboxamide-containing thiourea inhibitors of herpes viruses containing phenylenediamine groups AMERICAN HOME PROD (US) 2002-05-08 CN disclosed
EP-1144397-A2 HETEROCYCLIC CARBOXAMIDE-CONTAINING THIOUREA INHIBITORS OF HERPES VIRUSES CONTAINING PHENYLENEDIAMINE GROUP AMERICAN HOME PRODUCTS CORPORATION (US) 2001-10-17 EP disclosed
WO-2000034258-A2 HETEROCYCLIC CARBOXAMIDE-CONTAINING THIOUREA INHIBITORS OF HERPES VIRUSES CONTAINING PHENYLENEDIAMINE GROUP AMERICAN HOME PRODUCTS CORPORATION (US) 2000-06-15 WO disclosed