SCHEMBL7743472

SCHEMBL7743472

CC(NC(=S)Nc1ccc(NC(=O)c2cscn2)cc1)c1cccc(F)c1

nearest known ligand 0.49

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
BAZ1A Q9NRL2 1/20 0.45
ROCK2 O75116 3/20 0.43
ROCK1 Q13464 3/20 0.43
GRM4 Q14833 2/20 0.42
GRM1 Q13255 1/20 0.42
MTOR P42345 1/20 0.42
CYP2C9 P11712 3/20 0.41
CYP2C8 P10632 2/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
KDR P35968 1/20 0.40
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
QPCT Q16769 1/20 0.39
MAPK1 P28482 1/20 0.39
GPR139 Q6DWJ6 1/20 0.39
LMNA P02545 1/20 0.39
POLB P06746 1/20 0.39
MAPT P10636 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
SCHEMBL7737829 0.89 KCNA5 (0.44) GRM4GRM1CYP2C9CYP2C8SMN1; SMN2
SCHEMBL7743962 0.88 F7 (0.46) GRM4GRM1CYP2C9CYP2C8SMN1; SMN2
SCHEMBL7743318 0.87 MEN1 (0.41) GRM4GRM1CYP2C9CYP2C8SMN1; SMN2
SCHEMBL27577703 0.85 GRM4 (0.40) GRM4GRM1CYP2C9CYP2C8KDR
SCHEMBL7743937 0.85 POLB (0.42) GRM4GRM1SMN1; SMN2MEN1KMT2A
SCHEMBL7743960 0.85 KMT2A (0.44) GRM4GRM1SMN1; SMN2KDRMEN1
SCHEMBL7743347 0.85 MEN1 (0.43) GRM4GRM1SMN1; SMN2MEN1KMT2A
SCHEMBL7743480 0.85 CYP2C9 (0.44) GRM4CYP2C9CYP2C8SMN1; SMN2KDR
SCHEMBL7744020 0.84 MEN1 (0.53) GRM4GRM1SMN1; SMN2MEN1KMT2A
SCHEMBL7743904 0.84 ALDH1A1 (0.46) GRM4GRM1SMN1; SMN2MEN1KMT2A

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

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