SCHEMBL7559786

SCHEMBL7559786

O=C1NC(=O)/C(=C\c2ccc(-c3ccc(Cl)cc3)cc2)S1

nearest known ligand 0.90

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PIM1 P11309 10/20 0.90
PIM2 Q9P1W9 9/20 0.90
MYC P01106 1/20 0.69
NAT1 P18440 1/20 0.69
MAX P61244 1/20 0.69
IGF1R P08069 2/20 0.64
PIM3 Q86V86 1/20 0.64
HPGD P15428 2/20 0.62
RAB9A P51151 2/20 0.62
GSK3B P49841 2/20 0.62
MAOA P21397 2/20 0.62
AKR1B1 P15121 2/20 0.62
TDP1 Q9NUW8 1/20 0.62
MAOB P27338 1/20 0.62
NPC1 O15118 1/20 0.60
HTT P42858 1/20 0.60
CISD1 Q9NZ45 2/20 0.60

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
SCHEMBL7559789 1.00 PIM1 (0.90) PIM1PIM2MYCNAT1MAX
SCHEMBL261188 0.95 PIM1 (1.00) PIM1PIM2MYCNAT1MAX
SCHEMBL261187 0.95 PIM1 (1.00) PIM1PIM2MYCNAT1MAX
SCHEMBL2544039 0.95 PIM1 (1.00) PIM1PIM2MYCNAT1MAX
SCHEMBL1248780 0.84 PIM1 (0.83) PIM1PIM2NAT1PIM3HPGD
SCHEMBL1248782 0.84 PIM1 (0.83) PIM1PIM2NAT1PIM3HPGD
SCHEMBL12891790 0.84 PIM1 (0.83) PIM1PIM2NAT1PIM3HPGD
SCHEMBL1250231 0.82 PIM1 (0.77) PIM1PIM2NAT1IGF1RPIM3
SCHEMBL1250232 0.82 PIM1 (0.77) PIM1PIM2NAT1IGF1RPIM3
SCHEMBL20816059 0.81 NAT1 (1.00) PIM1PIM2MYCNAT1MAX

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2002062337-A1 THIAZOLIDINEDIONES SMITHKLINE BEECHAM CORPORATION (US) 2002-08-15 WO claimed
WO-2002062337-A1 THIAZOLIDINEDIONES SMITHKLINE BEECHAM CORPORATION (US) 2002-08-15 WO disclosed