SCHEMBL6815325

SCHEMBL6815325

O=C(Nc1ccc(NC(=S)NCCOc2cccc(Br)c2)cc1)c1csnn1

nearest known ligand 0.48

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MAPT P10636 7/20 0.48
MEN1 O00255 4/20 0.48
KMT2A Q03164 4/20 0.48
TP53 P04637 4/20 0.48
THRB P10828 2/20 0.48
ALDH1A1 P00352 6/20 0.46
LMNA P02545 2/20 0.46
SMN1; SMN2 Q16637 3/20 0.43
NPC1 O15118 2/20 0.43
RAB9A P51151 2/20 0.43
POLB P06746 1/20 0.43
HPGD P15428 1/20 0.43
KDM4E B2RXH2 3/20 0.41
GAA P10253 1/20 0.41
KLKB1 P03952 1/20 0.40

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
SCHEMBL6814982 0.89 THRB (0.56) MAPTMEN1KMT2ATP53THRB
SCHEMBL6811546 0.89 MAPT (0.54) MAPTMEN1KMT2ATP53THRB
SCHEMBL6813903 0.89 MAPT (0.48) MAPTMEN1KMT2ATP53THRB
SCHEMBL6812046 0.89 MAPT (0.48) MAPTMEN1KMT2ATP53THRB
SCHEMBL6811687 0.88 MAPT (0.57) MAPTMEN1KMT2ATP53THRB
SCHEMBL6816097 0.85 MAPT (0.52) MAPTMEN1KMT2ATP53THRB
SCHEMBL6816416 0.85 MAPT (0.51) MAPTMEN1KMT2ATP53THRB
SCHEMBL6815214 0.83 CNR1 (0.53) MAPTMEN1KMT2ATP53THRB
SCHEMBL6814939 0.83 MAPT (0.54) MAPTMEN1KMT2ATP53THRB
SCHEMBL6816313 0.83 MAPT (0.46) MAPTMEN1KMT2ATP53THRB

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 5 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-6262090-B1 Aminopyridine-containing thiourea inhibitors of herpes viruses AMERICAN HOME PRODUCTS CORPORATION 2001-07-17 US disclosed