SCHEMBL6815786

SCHEMBL6815786

CC(=O)Nc1ccc(NC(=S)Nc2ccc([N+](=O)[O-])cc2)cc1

nearest known ligand 0.76

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 8/20 0.76
ALDH1A1 P00352 9/20 0.71
SMN1; SMN2 Q16637 5/20 0.71
KMT2A Q03164 5/20 0.69
KDM4E B2RXH2 3/20 0.68
MEN1 O00255 4/20 0.64
HPGD P15428 2/20 0.64
TDP1 Q9NUW8 2/20 0.64
CYP3A4 P08684 1/20 0.64
GAA P10253 2/20 0.62
POLB P06746 2/20 0.60
HSP90AA1 P07900 1/20 0.59
LMNA P02545 4/20 0.58
HTT P42858 3/20 0.58
NPC1 O15118 2/20 0.58
MAPK1 P28482 1/20 0.58
NPSR1 Q6W5P4 2/20 0.58
TP53 P04637 1/20 0.58
L3MBTL1 Q9Y468 1/20 0.58
ALOX12 P18054 1/20 0.57

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
SCHEMBL642700 0.91 KMT2A (0.81) MAPTALDH1A1SMN1; SMN2KMT2AKDM4E
SCHEMBL16922176 0.91 KMT2A (0.81) MAPTALDH1A1SMN1; SMN2KMT2AKDM4E
Phosphine SCHEMBL28320532 0.90 KMT2A (0.78) MAPTALDH1A1SMN1; SMN2KMT2AKDM4E
SCHEMBL6301912 0.89 ALDH1A1 (0.79) MAPTALDH1A1SMN1; SMN2KMT2AKDM4E
SCHEMBL14633632 0.89 ALDH1A1 (0.79) MAPTALDH1A1SMN1; SMN2KMT2AKDM4E
SCHEMBL6811011 0.85 SMN1; SMN2 (0.81) MAPTALDH1A1SMN1; SMN2KMT2AMEN1
SCHEMBL16786362 0.85 ALDH1A1 (0.73) MAPTALDH1A1SMN1; SMN2KMT2AKDM4E
SCHEMBL6297678 0.84 ALDH1A1 (0.72) MAPTALDH1A1SMN1; SMN2KMT2AKDM4E
1,2-Dichloroethane SCHEMBL29197936 0.83 KMT2A (0.69) MAPTALDH1A1SMN1; SMN2KMT2AKDM4E
SCHEMBL27922872 0.83 ALDH1A1 (0.71) MAPTALDH1A1SMN1; SMN2KMT2AKDM4E

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 40 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116768770-A Diaryl thiourea compound and application thereof 上海交通大学医学院 2023-09-19 CN disclosed
CN-1165531-C Alpha-methylbenzyl-containing thiourea inhibitors of herpes viruses containing phenylenediamine groups 2004-09-08 CN disclosed
EP-1137632-B1 THIOUREA INHIBITORS OF HERPES VIRUSES WYETH CORP (US) 2004-07-28 EP disclosed
EP-1137645-B1 ALPHA-METHYLBENZYL-CONTAINING THIOUREA INHIBITORS OF HERPES VIRUSES CONTAINING A PHENYLENEDIAMINE GROUP WYETH CORP (US) 2004-05-26 EP disclosed
US-6555561-B2 N-(5-((((5-Chloro-2,4-dimethoxyphenyl)amino)thioxomethyl)-amino)-2 -pyridinyl)-2-methylbenzamide, for example; inhibiting replication of a herpes virus WYETH 2003-04-29 US disclosed
US-6462055-B2 VIRICIDES WYETH 2002-10-08 US disclosed
EP-1144397-A3 HETEROCYCLIC CARBOXAMIDE-CONTAINING THIOUREA INHIBITORS OF HERPES VIRUSES CONTAINING PHENYLENEDIAMINE GROUP Wyeth (US) 2002-09-11 EP 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
US-6426355-B1 VIRICIDES; PREVENTION PRODUCTION AMERICAN HOME PRODUCTS 2002-07-30 US disclosed
US-6410571-B1 VIRICIDES AMERICAN HOME PRODUCTS CORPORATION 2002-06-25 US disclosed
US-6207715-B1 USEFUL IN THERAPY OF DISEASES ASSOCIATED WITH HERPES VIRUSES INCLUDING HUMAN CYTOMEGALOVIRUS, HERPES SIMPLEX VIRUSES, EPSTEIN-BARR VIRUS, VARICELLA-ZOSTER VIRUS, HUMAN HERPESVIRUSES-6 AND -7, AND KAPOSI HERPES VIRUS AMERICAN HOME PRODUCTS CORPORATION 2001-03-27 US disclosed
US-6201013-B1 INOSINE MONOPHOSPHATE DEHYDROGENASE (IMPDH) INHIBITOR; SIDE EFFECT REDUCTION, NON-DRUG RESISTANT AMERICAN HOME PRODUCTS CORPORATION 2001-03-13 US disclosed
US-6197803-B1 VIRICIDES; PREVENTION REPRODUCTION AMERICAN HOME PRODUCTS CORPORATION 2001-03-06 US disclosed
US-6166028-A Diaminopuridine-containing thiourea inhibitors of herpes viruses AMERICAN HOME PRODUCTS CORPORATION (US) 2000-12-26 US disclosed
WO-2000034238-A1 THIOUREA INHIBITORS OF HERPES VIRUSES AMERICAN HOME PRODUCTS CORPORATION (US) 2000-06-15 WO disclosed
WO-2000034269-A1 THIOUREA INHIBITORS OF HERPES VIRUSES AMERICAN HOME PRODUCTS CORPORATION (US) 2000-06-15 WO disclosed
WO-2000034268-A1 THIOUREA INHIBITORS OF HERPES VIRUSES AMERICAN HOME PRODUCTS CORPORATION (US) 2000-06-15 WO disclosed
WO-2000034260-A2 ALPHA-METHYLBENZYL-CONTAINING THIOUREA INHIBITORS OF HERPES VIRUSES CONTAINING A PHENYLENEDIAMINE GROUP AMERICAN HOME PRODUCTS CORPORATION (US) 2000-06-15 WO 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
WO-2000034237-A2 ACETAMIDE AND SUBSTITUTED ACETAMIDE-CONTAINING THIOUREA INHIBITORS OF HERPES VIRUSES AMERICAN HOME PRODUCTS CORPORATION (US) 2000-06-15 WO disclosed