SCHEMBL7784336

SCHEMBL7784336

CC(CNC(=O)N(S)c1ccc(NC(=O)c2ccccc2F)cc1)Cc1ccc(F)cc1

nearest known ligand 0.52

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.52
RAB9A P51151 9/20 0.51
NPC1 O15118 8/20 0.51
SMN1; SMN2 Q16637 6/20 0.51
MAPT P10636 4/20 0.51
TP53 P04637 2/20 0.51
NFKB1 P19838 1/20 0.51
NFKB2 Q00653 1/20 0.51
RELA Q04206 1/20 0.51
MEN1 O00255 4/20 0.46
KMT2A Q03164 4/20 0.46
TDP1 Q9NUW8 2/20 0.46
KDM4E B2RXH2 3/20 0.43
POLB P06746 2/20 0.43
NPSR1 Q6W5P4 1/20 0.43
CTDSP1 Q9GZU7 1/20 0.42
HTT P42858 1/20 0.40
ALDH1A1 P00352 1/20 0.39
HPGD P15428 1/20 0.39

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
SCHEMBL7574664 0.83 LMNA (0.55) LMNARAB9ANPC1SMN1; SMN2MAPT
SCHEMBL6816350 0.83 LMNA (0.57) LMNARAB9ANPC1SMN1; SMN2MAPT
SCHEMBL7571039 0.82 RAB9A (0.55) LMNARAB9ANPC1SMN1; SMN2MAPT
SCHEMBL7565655 0.81 LMNA (0.55) LMNARAB9ANPC1SMN1; SMN2MAPT
SCHEMBL7569621 0.80 LMNA (0.54) LMNARAB9ANPC1SMN1; SMN2MAPT
SCHEMBL6819627 0.79 LMNA (0.57) LMNARAB9ANPC1SMN1; SMN2MAPT
SCHEMBL6816335 0.79 LMNA (0.52) LMNARAB9ANPC1SMN1; SMN2MAPT
SCHEMBL6816465 0.78 NPC1 (0.57) LMNARAB9ANPC1SMN1; SMN2MAPT
SCHEMBL6814055 0.78 NPC1 (0.60) LMNARAB9ANPC1SMN1; SMN2MAPT
SCHEMBL6815749 0.78 NPC1 (0.54) LMNARAB9ANPC1SMN1; SMN2MAPT

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-1144397-A3 HETEROCYCLIC CARBOXAMIDE-CONTAINING THIOUREA INHIBITORS OF HERPES VIRUSES CONTAINING PHENYLENEDIAMINE GROUP Wyeth (US) 2002-09-11 EP disclosed
EP-1144397-A2 HETEROCYCLIC CARBOXAMIDE-CONTAINING THIOUREA INHIBITORS OF HERPES VIRUSES CONTAINING PHENYLENEDIAMINE GROUP AMERICAN HOME PRODUCTS CORPORATION (US) 2001-10-17 EP disclosed
EP-1137645-A2 ALPHA-METHYLBENZYL-CONTAINING THIOUREA INHIBITORS OF HERPES VIRUSES CONTAINING A PHENYLENEDIAMINE GROUP AMERICAN HOME PRODUCTS CORPORATION (US) 2001-10-04 EP disclosed
EP-1137633-A2 ACETAMIDE AND SUBSTITUTED ACETAMIDE-CONTAINING THIOUREA INHIBITORS OF HERPES VIRUSES AMERICAN HOME PRODUCTS CORPORATION (US) 2001-10-04 EP disclosed
EP-1137647-A1 THIOUREA INHIBITORS OF HERPES VIRUSES AMERICAN HOME PRODUCTS CORPORATION (US) 2001-10-04 EP 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-2000034268-A1 THIOUREA INHIBITORS OF HERPES VIRUSES 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