SCHEMBL8944831

SCHEMBL8944831

CCOC(=O)/C(C)=C(/O)C(=O)OCC

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.48
LMNA P02545 1/20 0.48
HSD17B10 Q99714 1/20 0.48
GLO1 Q04760 1/20 0.46
EGLN1 Q9GZT9 1/20 0.43
MAPT P10636 3/20 0.42
NPSR1 Q6W5P4 1/20 0.41
CYP2D6 P10635 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
ALOX15 P16050 1/20 0.40
TSHR P16473 1/20 0.40
MGAM O43451 1/20 0.40
GAA P10253 1/20 0.40
SI P14410 1/20 0.40
MGAM2 Q2M2H8 1/20 0.40
SOAT1 P35610 1/20 0.40
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
HCAR2 Q8TDS4 1/20 0.38
TRPA1 O75762 1/20 0.37

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
SCHEMBL14186860 1.00 ALDH1A1 (0.48) ALDH1A1LMNAHSD17B10GLO1EGLN1
SCHEMBL4837263 0.88 GLO1 (0.50) ALDH1A1LMNAHSD17B10GLO1EGLN1
SCHEMBL12600412 0.88 ALDH1A1 (0.46) ALDH1A1LMNAHSD17B10GLO1EGLN1
SCHEMBL4837267 0.88 GLO1 (0.50) ALDH1A1LMNAHSD17B10GLO1EGLN1
SCHEMBL26663491 0.87 ALDH1A1 (0.50) ALDH1A1LMNAHSD17B10GLO1EGLN1
SCHEMBL4456094 0.87 ALDH1A1 (0.50) ALDH1A1LMNAHSD17B10GLO1EGLN1
SCHEMBL15962409 0.87 ALDH1A1 (0.50) ALDH1A1LMNAHSD17B10GLO1EGLN1
SCHEMBL4544969 0.86 ALDH1A1 (0.50) ALDH1A1LMNAHSD17B10GLO1EGLN1
SCHEMBL13377915 0.84 ALDH1A1 (0.45) ALDH1A1LMNAHSD17B10GLO1EGLN1
SCHEMBL5611950 0.84 ALDH1A1 (0.58) ALDH1A1LMNAHSD17B10GLO1EGLN1

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
US-5520834-A VINYL ETHERS BASF AKTIENGESELLSCHAFT (DE) 1996-05-28 US disclosed
US-5466762-A Block copolyacetals, preparation thereof and use thereof in detergents and cleaners BASF AKTIENGESELLSCHAFT (DE) 1995-11-14 US disclosed
US-5374681-A Phosphate-free detergent BASF AKTIENGESELLSCHAFT (DE) 1994-12-20 US disclosed
US-5330675-A Use of polyacetals based on vinyl ethers and dihydroxy compounds in detergents and cleaners and polyacetals BASF AKTIENGESELLSCHAFT (DE) 1994-07-19 US disclosed