SCHEMBL5224540

SCHEMBL5224540

NC(=O)c1cccc(C(=O)Nc2ccccc2NC(=O)c2sc3ccccc3c2Cl)c1

nearest known ligand 0.60

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PRSS12 P56730 12/20 0.60
MAPT P10636 2/20 0.56
OGG1 O15527 1/20 0.55
F10 P00742 4/20 0.55
HDAC1 Q13547 1/20 0.53
HDAC8 Q9BY41 1/20 0.53
HDAC6 Q9UBN7 1/20 0.53

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
SCHEMBL5224161 0.83 PRSS12 (0.60) PRSS12MAPTF10HDAC1HDAC8
SCHEMBL16210507 0.82 F10 (0.70) PRSS12MAPTOGG1F10HDAC1
SCHEMBL7249817 0.80 F10 (0.51) MAPTOGG1F10HDAC1HDAC8
SCHEMBL16562251 0.78 MAPT (0.65) PRSS12MAPTF10
SCHEMBL2248037 0.76 F10 (0.69) PRSS12MAPTOGG1F10HDAC1
SCHEMBL3774866 0.76 MEN1 (0.63) MAPTHDAC1HDAC8HDAC6
SCHEMBL4651922 0.75 MAPT (0.78) PRSS12MAPTF10
SCHEMBL6351071 0.74 PRSS12 (0.69) PRSS12F10
SCHEMBL6509362 0.74 OGG1 (0.54) PRSS12MAPTOGG1F10HDAC1
SCHEMBL7675240 0.73 MCL1 (0.71) MAPTOGG1HDAC1HDAC8HDAC6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1014962-A4 ANTITHROMBOTIC AGENTS LILLY CO ELI (US) 2007-06-27 EP disclosed
EP-1014962-A1 ANTITHROMBOTIC AGENTS ELI LILLY AND COMPANY (US) 2000-07-05 EP disclosed
WO-1999000121-A1 ANTITHROMBOTIC AGENTS ELI LILLY AND COMPANY (US) 1999-01-07 WO disclosed