SCHEMBL8809537

SCHEMBL8809537

CC(C)=CCCn1cc(CC2SC(=O)NC2=O)c2ccccc21

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ICMT O60725 2/20 0.41
PPARG P37231 5/20 0.40
FFAR1 O14842 4/20 0.40
CA2 P00918 1/20 0.38
PPARA Q07869 2/20 0.36
MAOA P21397 2/20 0.36
CISD1 Q9NZ45 2/20 0.36
MAPT P10636 1/20 0.36
CREBBP Q92793 1/20 0.36
CDC25A P30304 1/20 0.35
KCNH2 Q12809 1/20 0.35
MAOB P27338 1/20 0.34
ALDH1A1 P00352 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34
CNR2 P34972 1/20 0.34

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
SCHEMBL8810162 0.86 PPARG (0.44) PPARGFFAR1CA2PPARAMAOA
SCHEMBL8685503 0.81 HTR6 (0.49) PPARGFFAR1CA2PPARAMAPT
SCHEMBL8809547 0.81 ICMT (0.41) ICMTCREBBPCDC25ACNR2
SCHEMBL8809682 0.79 PPARG (0.42) ICMTPPARGFFAR1CA2PPARA
SCHEMBL8809908 0.79 MAPT (0.40) PPARGFFAR1CA2PPARAMAOA
SCHEMBL8685509 0.79 POLB (0.50) PPARGFFAR1PPARAALDH1A1NPSR1
SCHEMBL8811306 0.77 RAB9A (0.51) MAPTALDH1A1NPSR1
SCHEMBL8810491 0.76 PPARG (0.51) PPARGFFAR1MAPTKCNH2ALDH1A1
SCHEMBL8811662 0.76 CHRNB2 (0.52) PPARGFFAR1PPARAMAPTALDH1A1
SCHEMBL8690476 0.76 KMT2A (0.51) PPARGFFAR1MAPTNPSR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0780389-A1 Thiazolidinedione derivatives, process for their preparation and pharmaceutical compositions containing them TOBISHI PHARMACEUTICAL CO., LTD. (JP) 1997-06-25 EP disclosed