SCHEMBL27955432

SCHEMBL27955432

CCCCCCCCCCCCCCCCCCNC(=O)CCc1cc(C(C)(C)C)cc(C(C)(C)C)c1O

nearest known ligand 0.56

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
NR5A2 O00482 1/20 0.56
NR5A1 Q13285 1/20 0.56
KMT2A Q03164 4/20 0.55
GAA P10253 2/20 0.55
MEN1 O00255 3/20 0.52
MAPT P10636 2/20 0.52
ALDH1A1 P00352 1/20 0.52
SMN1; SMN2 Q16637 1/20 0.52
HPGD P15428 1/20 0.46
CASP2 P42575 1/20 0.46
NAAA Q02083 1/20 0.43
TRPV1 Q8NER1 2/20 0.42
HSD17B10 Q99714 1/20 0.42
GPR119 Q8TDV5 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
SCHEMBL28204520 1.00 NR5A2 (0.56) NR5A2NR5A1KMT2AGAAMEN1
SCHEMBL7942468 0.91 GAA (0.49) NR5A2NR5A1KMT2AGAAMEN1
SCHEMBL28136542 0.90 GAA (0.67) NR5A2NR5A1KMT2AGAAMEN1
SCHEMBL7942495 0.89 GAA (0.50) NR5A2NR5A1KMT2AGAAMEN1
SCHEMBL7943061 0.88 GAA (0.51) NR5A2NR5A1KMT2AGAAMEN1
SCHEMBL8608267 0.87 GAA (0.50) NR5A2NR5A1KMT2AGAAMEN1
Hexane SCHEMBL28237971 0.85 GAA (0.58) NR5A2NR5A1KMT2AGAAMEN1
SCHEMBL7943069 0.85 GAA (0.53) NR5A2NR5A1KMT2AGAAMEN1
SCHEMBL8606822 0.84 GAA (0.52) NR5A2NR5A1KMT2AGAAMEN1
SCHEMBL26382831 0.84 GAA (0.59) NR5A2NR5A1KMT2AGAAMEN1

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
CN-102482367-B Method for recycling of phenolic antioxidant agent, process for production of olefin polymer, polyolefin powder, and fibers ADEKA CORP 2014-05-07 CN disclosed