SCHEMBL7565649

SCHEMBL7565649

O=C(Nc1ccc(NC(=S)NCCCc2ccc(F)cc2)cc1)c1ccccc1F

nearest known ligand 0.61

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.61
KMT2A Q03164 9/20 0.57
MAPT P10636 6/20 0.57
ALDH1A1 P00352 5/20 0.57
HTT P42858 3/20 0.57
GAA P10253 1/20 0.57
SMN1; SMN2 Q16637 4/20 0.55
RAB9A P51151 2/20 0.55
NPC1 O15118 1/20 0.55
MEN1 O00255 4/20 0.55
TDP1 Q9NUW8 1/20 0.55
ALOX12 P18054 1/20 0.53
MAOB P27338 1/20 0.51
MAPK1 P28482 2/20 0.51
TP53 P04637 1/20 0.51
HDAC1 Q13547 1/20 0.51
POLB P06746 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
SCHEMBL7569618 0.96 LMNA (0.59) LMNAKMT2AMAPTALDH1A1HTT
SCHEMBL6819270 0.93 KMT2A (0.65) LMNAKMT2AMAPTALDH1A1HTT
SCHEMBL6816342 0.93 LMNA (0.64) LMNAKMT2AMAPTALDH1A1HTT
SCHEMBL6816652 0.86 RAB9A (0.73) LMNAKMT2AMAPTALDH1A1HTT
SCHEMBL7161984 0.85 KMT2A (0.65) LMNAKMT2AMAPTALDH1A1HTT
SCHEMBL7784386 0.84 MAPT (0.65) LMNAKMT2AMAPTALDH1A1GAA
SCHEMBL7596496 0.84 MAPT (0.66) LMNAKMT2AMAPTALDH1A1HTT
SCHEMBL7599459 0.84 RAB9A (0.60) LMNAKMT2AMAPTALDH1A1HTT
SCHEMBL7593646 0.82 RAB9A (0.58) LMNAKMT2AMAPTALDH1A1HTT
SCHEMBL7565655 0.82 LMNA (0.55) LMNAKMT2AMAPTHTTGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1144399-A3 HETEROCYCLIC CARBOXAMIDE-CONTAINING THIOUREA INHIBITORS OF HERPES VIRUSES CONTAINING A SUBSTITUTED PHENYLENEDIAMINE GROUP Wyeth (US) 2002-09-11 EP disclosed
EP-1144397-A3 HETEROCYCLIC CARBOXAMIDE-CONTAINING THIOUREA INHIBITORS OF HERPES VIRUSES CONTAINING PHENYLENEDIAMINE GROUP Wyeth (US) 2002-09-11 EP disclosed
EP-1144399-A2 HETEROCYCLIC CARBOXAMIDE-CONTAINING THIOUREA INHIBITORS OF HERPES VIRUSES CONTAINING A SUBSTITUTED PHENYLENEDIAMINE GROUP AMERICAN HOME PRODUCTS CORPORATION (US) 2001-10-17 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-1140913-A1 THIOUREA INHIBITORS OF HERPES VIRUSES AMERICAN HOME PRODUCTS CORPORATION (US) 2001-10-10 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
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-2000034269-A1 THIOUREA INHIBITORS OF HERPES VIRUSES AMERICAN HOME PRODUCTS CORPORATION (US) 2000-06-15 WO disclosed
WO-2000034261-A2 HETEROCYCLIC CARBOXAMIDE-CONTAINING THIOUREA INHIBITORS OF HERPES VIRUSES CONTAINING A SUBSTITUTED 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
WO-2000034258-A2 HETEROCYCLIC CARBOXAMIDE-CONTAINING THIOUREA INHIBITORS OF HERPES VIRUSES CONTAINING PHENYLENEDIAMINE GROUP AMERICAN HOME PRODUCTS CORPORATION (US) 2000-06-15 WO disclosed