SCHEMBL5319769

SCHEMBL5319769

C=CC(=O)SC(C)C(=O)O

nearest known ligand 0.35

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.35
TSHR P16473 2/20 0.34
ALDH1A1 P00352 2/20 0.33
TP53 P04637 1/20 0.33
HSD17B10 Q99714 1/20 0.32
KDM4E B2RXH2 1/20 0.31

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
SCHEMBL12227590 0.77
SCHEMBL23633101 0.75
SCHEMBL13121494 0.75
SCHEMBL29226146 0.73 LMNA (0.36) LMNATSHR
SCHEMBL5533886 0.73 TSHR (0.36) LMNATSHRALDH1A1
SCHEMBL179807 0.73
SCHEMBL19522869 0.72 TP53 (0.38) LMNAALDH1A1TP53HSD17B10KDM4E
SCHEMBL5742241 0.71 TSHR (0.34) TSHRALDH1A1
SCHEMBL31323093 0.71 TP53 (0.42) LMNAALDH1A1TP53HSD17B10KDM4E
SCHEMBL5526590 0.70

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
WO-2007070092-A2 METAL-CONTAINING COMPOSITIONS AND METHOD OF MAKING SAME PRYOG, LLC (US) 2007-06-21 WO disclosed