SCHEMBL7846063

SCHEMBL7846063

Cc1cccc(CCNC(=S)Nc2ccc(NC(=O)c3ccccc3F)cc2)c1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 9/20 0.64
MEN1 O00255 7/20 0.64
KMT2A Q03164 7/20 0.64
ALOX12 P18054 3/20 0.64
RAB9A P51151 7/20 0.57
LMNA P02545 8/20 0.53
ALDH1A1 P00352 5/20 0.53
HPGD P15428 1/20 0.53
CNR1 P21554 1/20 0.52
TDP1 Q9NUW8 1/20 0.51
NPC1 O15118 6/20 0.51
SMN1; SMN2 Q16637 4/20 0.51
GAA P10253 4/20 0.51
KDM4E B2RXH2 1/20 0.49
MAOA P21397 1/20 0.48
MAOB P27338 1/20 0.48
TP53 P04637 1/20 0.47
NFKB1 P19838 1/20 0.47
NFKB2 Q00653 1/20 0.47
RELA Q04206 1/20 0.47

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
SCHEMBL6814953 0.89 MAPT (0.60) MAPTMEN1KMT2AALOX12RAB9A
SCHEMBL7599459 0.88 RAB9A (0.60) MAPTMEN1KMT2AALOX12RAB9A
SCHEMBL6816652 0.88 RAB9A (0.73) MAPTMEN1KMT2AALOX12RAB9A
SCHEMBL7599212 0.87 RAB9A (0.57) MAPTMEN1KMT2AALOX12RAB9A
SCHEMBL6811342 0.87 RAB9A (0.65) MAPTMEN1KMT2AALOX12RAB9A
SCHEMBL7600319 0.87 CNR1 (0.54) MAPTMEN1KMT2AALOX12RAB9A
SCHEMBL7598142 0.87 RAB9A (0.60) MAPTMEN1KMT2AALOX12RAB9A
SCHEMBL7597608 0.85 CNR1 (0.55) MAPTMEN1KMT2AALOX12RAB9A
SCHEMBL7599037 0.85 CNR1 (0.54) MAPTMEN1KMT2AALOX12RAB9A
SCHEMBL7785389 0.84 RAB9A (0.60) MAPTMEN1KMT2AALOX12RAB9A

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-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-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-2000034268-A1 THIOUREA INHIBITORS OF HERPES VIRUSES 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