SCHEMBL636345

SCHEMBL636345

C=C(C)C(=O)OC.C=C(C)C(=O)OO

nearest known ligand 0.79

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.79
TSHR P16473 4/20 0.43
THRB P10828 1/20 0.35
TDP1 Q9NUW8 2/20 0.35
HSD17B10 Q99714 1/20 0.32
MGAM O43451 1/20 0.31
GAA P10253 1/20 0.31
SI P14410 1/20 0.31
MGAM2 Q2M2H8 1/20 0.31
MAPT P10636 1/20 0.30
TET2 Q6N021 1/20 0.30
EGLN1 Q9GZT9 1/20 0.30
THPO P40225 1/20 0.30

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
SCHEMBL8767405 0.89 ALDH1A1 (0.58) ALDH1A1TSHRTHRBTDP1HSD17B10
SCHEMBL179937 0.89
SCHEMBL10636466 0.89
SCHEMBL4390490 0.89 ALDH1A1 (1.00) ALDH1A1TSHRTHRBTDP1HSD17B10
SCHEMBL1849 0.89
SCHEMBL8627821 0.86
Ethylene SCHEMBL44117 0.86
SCHEMBL21340366 0.86
SCHEMBL20681605 0.86
Methyl Alcohol SCHEMBL1272141 0.86

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109715789-A Inside envelope determines lipid vesicle 中央研究院 2019-05-03 CN disclosed
CN-107406991-A Method for cleaning soiled metal surfaces and substance for use in said method 巴斯夫欧洲公司 2017-11-28 CN disclosed
EP-2419114-A1 BACTERIAL COMPOSITIONS FOR PROPHYLAXIS AND TREATMENT OF DEGENERATIVE DISEASE Micropharma Limited (CA) 2012-02-22 EP disclosed
WO-2010124387-A1 BACTERIAL COMPOSITIONS FOR PROPHYLAXIS AND TREATMENT OF DEGENERATIVE DISEASE MICROPHARMA LIMITED (CA) 2010-11-04 WO disclosed