SCHEMBL6583254

SCHEMBL6583254

[CH2]CCc1ccc(OCc2nc(-c3ccco3)oc2C)c(OC)c1

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PPARG P37231 3/20 0.66
MAPT P10636 6/20 0.49
SMN1; SMN2 Q16637 6/20 0.49
KDM4E B2RXH2 5/20 0.49
ALDH1A1 P00352 5/20 0.49
TSHR P16473 4/20 0.49
HSD17B10 Q99714 4/20 0.49
HPGD P15428 3/20 0.49
LMNA P02545 4/20 0.43
TDP1 Q9NUW8 4/20 0.43
RECQL P46063 2/20 0.43
ALOX15 P16050 3/20 0.43
NPSR1 Q6W5P4 2/20 0.43
TP53 P04637 3/20 0.43
MAPK1 P28482 3/20 0.43
USP2 O75604 2/20 0.43
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
NFKB1 P19838 1/20 0.42
NFKB2 Q00653 1/20 0.42

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
SCHEMBL6585691 0.89 PPARG (0.68) PPARGMAPTSMN1; SMN2KDM4EALDH1A1
SCHEMBL1732725 0.89 PPARG (0.62) PPARGMAPTSMN1; SMN2KDM4EALDH1A1
SCHEMBL4035637 0.89 PPARG (0.62) PPARGMAPTSMN1; SMN2KDM4EALDH1A1
SCHEMBL8340588 0.88 PPARG (0.60) PPARGMAPTSMN1; SMN2KDM4EALDH1A1
SCHEMBL6582034 0.87 PPARG (0.65) PPARGMAPTSMN1; SMN2KDM4EALDH1A1
SCHEMBL6584001 0.86 PPARG (0.67) PPARGMAPTSMN1; SMN2KDM4EALDH1A1
SCHEMBL4850543 0.85 PPARG (0.61) PPARGMAPTSMN1; SMN2KDM4EALDH1A1
SCHEMBL6582015 0.85 PPARG (0.61) PPARGMAPTSMN1; SMN2KDM4EALDH1A1
SCHEMBL4850848 0.84 PPARG (0.58) PPARGMAPTSMN1; SMN2KDM4EALDH1A1
SCHEMBL1731572 0.84 PPARG (0.58) PPARGMAPTSMN1; SMN2KDM4EALDH1A1

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
EP-0710659-B1 Oxazolidinedione derivatives, their production and use TAKEDA CHEMICAL INDUSTRIES LTD (JP) 2004-01-28 EP disclosed
EP-0710659-A1 Oxazolidinedione derivatives, their production and use TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1996-05-08 EP disclosed