SCHEMBL6811250

SCHEMBL6811250

CC(=O)Nc1cccc(NC(=S)Nc2ccc(NC(=O)c3csnn3)cc2)c1

nearest known ligand 0.76

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.76
THRB P10828 2/20 0.61
ALDH1A1 P00352 9/20 0.60
MAPT P10636 7/20 0.60
MEN1 O00255 5/20 0.60
KMT2A Q03164 5/20 0.60
TP53 P04637 4/20 0.56
POLB P06746 3/20 0.56
SMN1; SMN2 Q16637 2/20 0.56
KDR P35968 2/20 0.56
NPC1 O15118 1/20 0.56
HPGD P15428 1/20 0.56
RAB9A P51151 1/20 0.56
GAA P10253 1/20 0.54
KDM4E B2RXH2 1/20 0.51
USP2 O75604 1/20 0.50

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
SCHEMBL6815056 0.91 LMNA (0.72) LMNATHRBALDH1A1MAPTMEN1
SCHEMBL6810928 0.88 THRB (0.61) LMNATHRBALDH1A1MAPTMEN1
SCHEMBL6815847 0.86 THRB (0.82) LMNATHRBALDH1A1MAPTMEN1
SCHEMBL6814682 0.86 ALDH1A1 (0.79) LMNATHRBALDH1A1MAPTMEN1
SCHEMBL6815505 0.85 THRB (0.61) LMNATHRBALDH1A1MAPTMEN1
SCHEMBL7685333 0.85 THRB (0.61) LMNATHRBALDH1A1MAPTMEN1
SCHEMBL6815727 0.85 THRB (0.61) LMNATHRBALDH1A1MAPTMEN1
SCHEMBL6819483 0.85 THRB (0.61) LMNATHRBALDH1A1MAPTMEN1
SCHEMBL6819498 0.85 ALDH1A1 (0.64) LMNATHRBALDH1A1MAPTMEN1
SCHEMBL6815252 0.85 THRB (0.57) LMNATHRBALDH1A1MAPTMEN1

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 4 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-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