SCHEMBL7599459

SCHEMBL7599459

Cc1ccc(CCNC(=S)Nc2ccc(NC(=O)c3ccccc3F)cc2)cc1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 6/20 0.60
MAPT P10636 9/20 0.55
SMN1; SMN2 Q16637 6/20 0.55
NPC1 O15118 5/20 0.55
ALDH1A1 P00352 5/20 0.55
KMT2A Q03164 6/20 0.55
MEN1 O00255 4/20 0.55
TDP1 Q9NUW8 2/20 0.55
POLB P06746 2/20 0.53
LMNA P02545 6/20 0.52
KDM4E B2RXH2 2/20 0.52
GAA P10253 3/20 0.52
ALOX12 P18054 2/20 0.52
NPSR1 Q6W5P4 1/20 0.52
MAOA P21397 1/20 0.51
MAOB P27338 1/20 0.51
HTT P42858 1/20 0.51
MAPK1 P28482 1/20 0.51
TP53 P04637 2/20 0.50
NFKB1 P19838 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
SCHEMBL6816342 0.91 LMNA (0.64) RAB9AMAPTSMN1; SMN2NPC1ALDH1A1
SCHEMBL6816652 0.91 RAB9A (0.73) RAB9AMAPTSMN1; SMN2NPC1ALDH1A1
SCHEMBL7784386 0.89 MAPT (0.65) RAB9AMAPTSMN1; SMN2NPC1ALDH1A1
SCHEMBL7596496 0.89 MAPT (0.66) RAB9AMAPTSMN1; SMN2NPC1ALDH1A1
SCHEMBL7777740 0.88 KDM4E (0.69) RAB9AMAPTSMN1; SMN2ALDH1A1KMT2A
SCHEMBL7596301 0.88 RAB9A (0.57) RAB9AMAPTSMN1; SMN2NPC1ALDH1A1
SCHEMBL7846063 0.88 MAPT (0.64) RAB9AMAPTSMN1; SMN2NPC1ALDH1A1
SCHEMBL7593646 0.87 RAB9A (0.58) RAB9AMAPTSMN1; SMN2NPC1ALDH1A1
SCHEMBL7596706 0.86 ALDH1A1 (0.70) RAB9AMAPTSMN1; SMN2NPC1ALDH1A1
SCHEMBL7595962 0.86 RAB9A (0.57) RAB9AMAPTSMN1; SMN2NPC1ALDH1A1

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 14 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-1137632-A1 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-2000034269-A1 THIOUREA INHIBITORS OF HERPES VIRUSES AMERICAN HOME PRODUCTS CORPORATION (US) 2000-06-15 WO disclosed
WO-2000034238-A1 THIOUREA INHIBITORS OF HERPES VIRUSES AMERICAN HOME PRODUCTS CORPORATION (US) 2000-06-15 WO 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-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-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