SCHEMBL6817092

SCHEMBL6817092

Cc1ccc(NC(=S)Nc2ccc(NC(=O)c3csnn3)cc2)cc1Cl

nearest known ligand 0.62

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TP53 P04637 5/20 0.62
LMNA P02545 3/20 0.62
ALDH1A1 P00352 7/20 0.58
SMN1; SMN2 Q16637 3/20 0.58
HPGD P15428 2/20 0.58
NPC1 O15118 2/20 0.58
RAB9A P51151 2/20 0.58
POLB P06746 1/20 0.58
THRB P10828 2/20 0.56
MAPT P10636 10/20 0.56
MEN1 O00255 6/20 0.55
KMT2A Q03164 6/20 0.55
PPIA P62937 1/20 0.50
GAA P10253 1/20 0.49

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
SCHEMBL6815872 0.89 TP53 (0.62) TP53LMNAALDH1A1SMN1; SMN2HPGD
SCHEMBL6811667 0.86 TP53 (0.59) TP53LMNAALDH1A1SMN1; SMN2HPGD
SCHEMBL6815963 0.86 TP53 (0.59) TP53LMNAALDH1A1SMN1; SMN2HPGD
SCHEMBL6815720 0.86 THRB (0.60) TP53LMNAALDH1A1SMN1; SMN2HPGD
SCHEMBL6816253 0.86 LMNA (0.59) TP53LMNAALDH1A1SMN1; SMN2HPGD
SCHEMBL6819514 0.85 TP53 (0.87) TP53LMNAALDH1A1SMN1; SMN2HPGD
SCHEMBL6816161 0.85 TP53 (0.58) TP53LMNAALDH1A1SMN1; SMN2HPGD
SCHEMBL6811124 0.85 TP53 (0.67) TP53LMNAALDH1A1SMN1; SMN2HPGD
SCHEMBL6810928 0.84 THRB (0.61) TP53LMNAALDH1A1SMN1; SMN2HPGD
SCHEMBL6814915 0.84 ALDH1A1 (0.60) TP53LMNAALDH1A1SMN1; SMN2HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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-6426355-B1 VIRICIDES; PREVENTION PRODUCTION AMERICAN HOME PRODUCTS 2002-07-30 US disclosed
US-6335350-B1 VARICELLA-ZOSTER, HUMAN CYTOMEGALO, EPSTEIN-BARR AND KAPOSI HERPESVIRUS TREATMENT AMERICAN HOME PRODUCTS CORPORATION 2002-01-01 US disclosed
US-6262090-B1 Aminopyridine-containing thiourea inhibitors of herpes viruses AMERICAN HOME PRODUCTS CORPORATION 2001-07-17 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-6166028-A Diaminopuridine-containing thiourea inhibitors of herpes viruses AMERICAN HOME PRODUCTS CORPORATION (US) 2000-12-26 US disclosed