SCHEMBL7463446

SCHEMBL7463446

Cc1cc2c(cc1-c1c(O)cccc1C=C1SC(=O)NC1=O)C(C)(C)CCC2(C)C

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NAT1 P18440 2/20 0.53
TTR P02766 2/20 0.50
GSK3B P49841 2/20 0.47
TDP1 Q9NUW8 3/20 0.46
PIM1 P11309 1/20 0.46
PIM2 Q9P1W9 1/20 0.46
KDM4E B2RXH2 1/20 0.46
NSD2 O96028 1/20 0.46
POLB P06746 1/20 0.46
GAA P10253 1/20 0.46
MAPT P10636 1/20 0.46
MAPK1 P28482 1/20 0.46
RECQL P46063 1/20 0.46
GFER P55789 1/20 0.46
MCL1 Q07820 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
IGF1R P08069 2/20 0.44
GLS O94925 1/20 0.43
GLS2 Q9UI32 1/20 0.43
AKR1B1 P15121 2/20 0.43

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
SCHEMBL7463441 1.00 NAT1 (0.53) NAT1TTRGSK3BTDP1PIM1
SCHEMBL7468195 0.90 TTR (0.56) NAT1TTRGSK3BPIM1PIM2
SCHEMBL7468198 0.90 TTR (0.56) NAT1TTRGSK3BPIM1PIM2
SCHEMBL7460607 0.88 TTR (0.50) NAT1TTRGSK3BPIM1PIM2
SCHEMBL7460613 0.88 TTR (0.50) NAT1TTRGSK3BPIM1PIM2
SCHEMBL7465115 0.88 TTR (0.50) NAT1TTRGSK3BPIM1PIM2
SCHEMBL7465111 0.88 TTR (0.50) NAT1TTRGSK3BPIM1PIM2
SCHEMBL7465275 0.87 TTR (0.49) NAT1TTRGSK3BPIM1PIM2
SCHEMBL7465280 0.87 TTR (0.49) NAT1TTRGSK3BPIM1PIM2
SCHEMBL7464545 0.86 GSK3B (0.57) NAT1TTRGSK3BPIM1PIM2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1214305-A1 BENZYLIDENE-THIAZOLIDINEDIONES AND ANALOGUES AND THEIR USE IN THE TREATMENT OF INFLAMMATION Maxia Pharmaceuticals, Inc. (US) 2002-06-19 EP claimed
WO-2001016123-A1 BENZYLIDENE-THIAZOLIDINEDIONES AND ANALOGUES AND THEIR USE IN THE TREATMENT OF INFLAMMATION MAXIA PHARMACEUTICALS, INC. (US) 2001-03-08 WO claimed
EP-1214305-A1 BENZYLIDENE-THIAZOLIDINEDIONES AND ANALOGUES AND THEIR USE IN THE TREATMENT OF INFLAMMATION Maxia Pharmaceuticals, Inc. (US) 2002-06-19 EP disclosed
WO-2001016123-A1 BENZYLIDENE-THIAZOLIDINEDIONES AND ANALOGUES AND THEIR USE IN THE TREATMENT OF INFLAMMATION MAXIA PHARMACEUTICALS, INC. (US) 2001-03-08 WO disclosed