SCHEMBL6816253

SCHEMBL6816253

O=C(Nc1ccc(NC(=S)Nc2ccc(Br)c(Cl)c2)cc1)c1csnn1

nearest known ligand 0.59

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.59
TP53 P04637 4/20 0.59
MAPT P10636 11/20 0.57
ALDH1A1 P00352 8/20 0.57
PKM P14618 1/20 0.57
THRB P10828 2/20 0.56
MEN1 O00255 8/20 0.55
KMT2A Q03164 8/20 0.55
HPGD P15428 3/20 0.55
NPC1 O15118 3/20 0.55
SMN1; SMN2 Q16637 3/20 0.55
RAB9A P51151 2/20 0.55
POLB P06746 1/20 0.55
HTT P42858 1/20 0.50
ALOX15 P16050 1/20 0.48
ALOX12 P18054 1/20 0.48

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) LMNATP53MAPTALDH1A1THRB
SCHEMBL6811667 0.86 TP53 (0.59) LMNATP53MAPTALDH1A1THRB
SCHEMBL6815720 0.86 THRB (0.60) LMNATP53MAPTALDH1A1THRB
SCHEMBL6817092 0.86 TP53 (0.62) LMNATP53MAPTALDH1A1THRB
SCHEMBL6815963 0.86 TP53 (0.59) LMNATP53MAPTALDH1A1THRB
SCHEMBL6815493 0.85 LMNA (0.63) LMNATP53MAPTALDH1A1THRB
SCHEMBL6819483 0.84 THRB (0.61) LMNATP53MAPTALDH1A1THRB
SCHEMBL6810818 0.84 MAPT (0.59) LMNATP53MAPTALDH1A1THRB
SCHEMBL6815363 0.83 LMNA (0.65) LMNATP53MAPTALDH1A1THRB
SCHEMBL6819413 0.83 MAPT (0.57) LMNATP53MAPTALDH1A1THRB

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 8 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
EP-1144397-A2 HETEROCYCLIC CARBOXAMIDE-CONTAINING THIOUREA INHIBITORS OF HERPES VIRUSES CONTAINING PHENYLENEDIAMINE GROUP AMERICAN HOME PRODUCTS CORPORATION (US) 2001-10-17 EP 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-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-6407249-B1 COMPOUNDS CONTAINING FURAN RING STRUCTURE AMERICAN HOME PRODUCTS CORPORATION 2002-06-18 US disclosed
US-6262090-B1 Aminopyridine-containing thiourea inhibitors of herpes viruses AMERICAN HOME PRODUCTS CORPORATION 2001-07-17 US disclosed
US-6166028-A Diaminopuridine-containing thiourea inhibitors of herpes viruses AMERICAN HOME PRODUCTS CORPORATION (US) 2000-12-26 US disclosed