SCHEMBL7605166

SCHEMBL7605166

CCOC(C)(O)CC(=O)O

nearest known ligand 0.50

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
HMGCR P04035 1/20 0.50
CHRM1 P11229 1/20 0.50
TBXA2R P21731 1/20 0.50
ADRA1A P35348 1/20 0.50
CYP2C19 P33261 2/20 0.42
HIF1A Q16665 2/20 0.42
TSHR P16473 2/20 0.42
CYP2D6 P10635 1/20 0.42
ALDH1A1 P00352 2/20 0.39
KDM4E B2RXH2 1/20 0.38
FFAR1 O14842 1/20 0.38
CPT2 P23786 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
EGLN1 Q9GZT9 1/20 0.38
FFAR3 O14843 1/20 0.35
SLC13A5 Q86YT5 2/20 0.33
ACLY P53396 2/20 0.32
HCAR2 Q8TDS4 1/20 0.32

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
SCHEMBL19029705 0.79 HMGCR (0.43) HMGCRCHRM1TBXA2RADRA1ACYP2C19
SCHEMBL24754736 0.78 HMGCR (0.46) HMGCRCHRM1TBXA2RADRA1ACYP2C19
SCHEMBL3654996 0.78 HMGCR (0.46) HMGCRCHRM1TBXA2RADRA1ACYP2C19
Acetic Acid SCHEMBL27604904 0.76 ALDH1A1 (0.35) HMGCRCHRM1TBXA2RADRA1ATSHR
SCHEMBL18359245 0.76 HMGCR (0.36) HMGCRCHRM1TBXA2RADRA1ACYP2C19
SCHEMBL30686973 0.75 HMGCR (0.42) HMGCRCHRM1TBXA2RADRA1ACYP2C19
SCHEMBL5634001 0.75 HMGCR (0.42) HMGCRCHRM1TBXA2RADRA1ACYP2C19
SCHEMBL4622329 0.75
SCHEMBL18741280 0.74 HMGCR (0.42) HMGCRCHRM1TBXA2RADRA1ACYP2C19
SCHEMBL9242492 0.73 HMGCR (0.41) HMGCRCHRM1TBXA2RADRA1ACYP2C19

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0967967-B1 COSMETIC, DERMOPHARMACEUTICAL OR VETERINARY COMPOSITIONS FOR DISINFECTING HUMAN OR ANIMAL SKIN STOA SA (FR) 2002-07-10 EP disclosed
EP-0967967-A1 COSMETIC, DERMOPHARMACEUTICAL OR VETERINARY COMPOSITIONS FOR DISINFECTING HUMAN OR ANIMAL SKIN Stoa S.A. (FR) 2000-01-05 EP disclosed
EP-0843556-A1 GLYCERYL POLY(METH)ACRYLATE TYPE GEL BASED PHARMACEUTICAL COMPOSITIONS Stoa S.A. (FR) 1998-05-27 EP disclosed
WO-1998003152-A1 COMPOSITIONS FOR TREATING SUNBURN AND ORAL HYGIENE PROBLEMS SEDERMA S.A. (FR) 1998-01-29 WO disclosed
WO-1997047310-A1 GLYCERYL POLY(METH)ACRYLATE TYPE GEL BASED PHARMACEUTICAL COMPOSITIONS STOA S.A. (FR) 1997-12-18 WO disclosed
WO-1997030692-A1 COSMETIC, DERMOPHARMACEUTICAL OR VETERINARY COMPOSITIONS FOR DISINFECTING HUMAN OR ANIMAL SKIN STOA S.A. (FR) 1997-08-28 WO disclosed
EP-0147996-B1 ADHESION ACTIVATED ARAMID FIBER E.I. DU PONT DE NEMOURS AND COMPANY (US) 1989-05-10 EP disclosed
EP-0147996-A2 Adhesion activated aramid fiber E.I. DU PONT DE NEMOURS AND COMPANY (US) 1985-07-10 EP disclosed
US-4510202-A UNDERCOATING OF THE REACTION PRODUCT OF AN EPOXIDE AND PHENOLIC OR AMINO RESIN; TIRE CORD E. I. DU PONT DE NEMOURS AND COMPANY (US) 1985-04-09 US disclosed
US-4387036-A 1-Ethoxy-1-ethanol acetate-acetaldehyde mixtures for augmenting or enhancing the aroma of detergents INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) 1983-06-07 US disclosed