SCHEMBL9032154

SCHEMBL9032154

O=Cc1ccc(OC[C@H]2CCCN2c2nc3ccccc3s2)cc1

nearest known ligand 0.49

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ATP4A P20648 4/20 0.41
ATP4B P51164 4/20 0.41
LTA4H P09960 4/20 0.41
MAPT P10636 3/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
NPC1 O15118 2/20 0.40
TP53 P04637 2/20 0.40
RAB9A P51151 2/20 0.40
GLO1 Q04760 1/20 0.40
KCNH2 Q12809 1/20 0.40
BACE1 P56817 1/20 0.39
KDM4E B2RXH2 1/20 0.38
MEN1 O00255 1/20 0.38
ALDH1A1 P00352 1/20 0.38
LMNA P02545 1/20 0.38
HTT P42858 1/20 0.38
KMT2A Q03164 1/20 0.38

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
SCHEMBL9031383 1.00 ATP4A (0.41) ATP4AATP4BLTA4HMAPTSMN1; SMN2
SCHEMBL9032163 1.00 ATP4A (0.41) ATP4AATP4BLTA4HMAPTSMN1; SMN2
SCHEMBL9032465 0.86 NPC1 (0.44) MAPTSMN1; SMN2NPC1TP53RAB9A
SCHEMBL9032458 0.86 NPC1 (0.44) MAPTSMN1; SMN2NPC1TP53RAB9A
SCHEMBL9032333 0.85 PPARG (0.55)
SCHEMBL9032832 0.85 PPARG (0.55)
SCHEMBL9429664 0.85 PPARG (0.55)
SCHEMBL9311972 0.85 PPARG (0.55)
SCHEMBL9429676 0.84 PPARG (0.45) LTA4HMAPTNPC1RAB9AKCNH2
SCHEMBL9311984 0.84 PPARG (0.45) LTA4HMAPTNPC1RAB9AKCNH2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0528734-B1 Thiazolidin-2,4-dione derivatives, process for their preparation and pharmaceutical compositions containing them ADIR (FR) 1996-10-23 EP disclosed
US-5330999-A Diabetes, obesity ADIR ET COMPAGNIE (FR) 1994-07-19 US disclosed
US-5296605-A 2,4-thiazolidinedione compounds ADIR ET COMPAGNIE (FR) 1994-03-22 US disclosed
US-5266582-A Antidiabetic agents ADIR ET COMPAGNIE (FR) 1993-11-30 US disclosed
EP-0528734-A1 Thiazolidin-2,4-dione derivatives, process for their preparation and pharmaceutical compositions containing them ADIR ET COMPAGNIE (FR) 1993-02-24 EP disclosed