SCHEMBL8207151

SCHEMBL8207151

COC(=O)C(C)(O)CC(=O)N(C)C

nearest known ligand 0.34

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
DGAT1 O75907 1/20 0.34
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
TSHR P16473 3/20 0.32
ALDH1A1 P00352 1/20 0.31
USP2 O75604 1/20 0.31
LMNA P02545 1/20 0.31
MGAM O43451 2/20 0.30
GAA P10253 2/20 0.30
SI P14410 2/20 0.30
MGAM2 Q2M2H8 2/20 0.30
HSD17B10 Q99714 1/20 0.30
HMGCR P04035 1/20 0.30
CHRM1 P11229 1/20 0.30
TBXA2R P21731 1/20 0.30
ADRA1A P35348 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
SCHEMBL3190230 0.82 STING1 (0.40) MEN1KMT2ATSHRALDH1A1LMNA
SCHEMBL3280983 0.80 TSHR (0.42) DGAT1MEN1KMT2ATSHRUSP2
SCHEMBL15412844 0.80 TSHR (0.42) DGAT1MEN1KMT2ATSHRUSP2
SCHEMBL4628164 0.76 HMGCR (0.50) DGAT1TSHRALDH1A1HMGCRCHRM1
SCHEMBL4954398 0.74 ALDH1A1 (0.33) ALDH1A1HMGCRCHRM1TBXA2RADRA1A
SCHEMBL14159859 0.72 ALDH1A1 (0.39) TSHRALDH1A1HMGCRCHRM1TBXA2R
SCHEMBL1964305 0.70
SCHEMBL3827004 0.70
SCHEMBL28869957 0.70
SCHEMBL1063211 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1016698-A1 Use of a solvent composition containing an oxyisobutyric acid ester as a solvent in coatings, adhesives and printing inks Mitsubishi Rayon Co., Ltd. (JP) 2000-07-05 EP disclosed
EP-1016699-A1 Use of a solvent composition comprising an oxyisobutyric acid ester as a cleaning agent Mitsubishi Rayon Co., Ltd. (JP) 2000-07-05 EP disclosed
EP-0629671-A2 Solvent composition NITTO CHEMICAL INDUSTRY CO., LTD. (JP) 1994-12-21 EP disclosed