SCHEMBL7459735

SCHEMBL7459735

CC1(C)CCC(C)(C)c2cc(C(F)(F)F)c(-c3c(Cl)cccc3CN3C(=O)CSC3=O)cc21

nearest known ligand 0.42

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PIM1 P11309 1/20 0.42
GSK3A P49840 1/20 0.40
GSK3B P49841 1/20 0.40
POLB P06746 1/20 0.37
KCNN4 O15554 9/20 0.37
ALDH1A1 P00352 1/20 0.37
C5AR1 P21730 2/20 0.34
RECQL P46063 1/20 0.33
P2RX7 Q99572 1/20 0.33
NR1H2 P55055 1/20 0.32
NR1H3 Q13133 1/20 0.32
CHRM5 P08912 1/20 0.32

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
SCHEMBL7469002 0.91 PIM1 (0.43) PIM1GSK3AGSK3BPOLBKCNN4
SCHEMBL7463920 0.88 PIM1 (0.40) PIM1GSK3AGSK3BPOLBKCNN4
SCHEMBL7462920 0.87 PIM1 (0.40) PIM1GSK3AGSK3BPOLBKCNN4
SCHEMBL7470578 0.86 GSK3A (0.43) PIM1GSK3AGSK3BPOLBKCNN4
SCHEMBL7470549 0.85 PIM1 (0.42) PIM1GSK3AGSK3BPOLBKCNN4
SCHEMBL7459796 0.82 POLB (0.45) PIM1GSK3AGSK3BPOLBKCNN4
SCHEMBL7463053 0.79 POLB (0.43) PIM1GSK3AGSK3BPOLBKCNN4
SCHEMBL7464451 0.78 PIM1 (0.44) PIM1GSK3AGSK3BPOLBKCNN4
SCHEMBL7464136 0.77 PIM1 (0.44) PIM1GSK3AGSK3BPOLBKCNN4
SCHEMBL7461597 0.77 KCNN4 (0.41) PIM1GSK3AGSK3BKCNN4ALDH1A1

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