SCHEMBL21444950

SCHEMBL21444950

C=CON1C(C)(C)CC(OC(=O)OC2CC(C)(C)N(O)C(C)(C)C2)CC1(C)C

nearest known ligand 0.41

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
GAA P10253 3/20 0.41
HTT P42858 1/20 0.41
TSHR P16473 2/20 0.36
KMT2A Q03164 1/20 0.36
ALDH1A1 P00352 1/20 0.35
ESR1 P03372 1/20 0.35
HSD17B10 Q99714 1/20 0.35
KDM4E B2RXH2 1/20 0.31
L3MBTL1 Q9Y468 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
SCHEMBL3765199 0.85 GAA (0.50) GAAHTTTSHRKMT2AALDH1A1
SCHEMBL12227672 0.82 GAA (0.43) GAAHTTTSHRKMT2AALDH1A1
SCHEMBL12723132 0.80 GAA (0.47) GAAHTTTSHRKMT2AALDH1A1
SCHEMBL1053833 0.77 GAA (0.44) GAAHTTTSHRKMT2AALDH1A1
SCHEMBL19847514 0.76 GAA (0.39) GAAHTTTSHRKMT2AALDH1A1
SCHEMBL13487849 0.74 TSHR (0.42) GAAHTTTSHRKMT2AALDH1A1
SCHEMBL7526296 0.74 GAA (0.50) GAAHTTTSHRKMT2AALDH1A1
SCHEMBL16623964 0.74 TSHR (0.41) GAAHTTTSHRALDH1A1HSD17B10
SCHEMBL12921991 0.73 TSHR (0.39) GAAHTTTSHRKMT2AALDH1A1
SCHEMBL23355263 0.73 GAA (0.47) GAAHTTTSHRKMT2AALDH1A1

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-3075815-B1 LIGHT STABILIZER COMPOSITION AND RESIN COMPOSITION CONTAINING SAME ADEKA CORP (JP) 2019-10-09 EP disclosed