SCHEMBL6671561

SCHEMBL6671561

CCCOC(=O)C(O)CCl

nearest known ligand 0.48

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HCAR2 Q8TDS4 1/20 0.38
ALDH1A1 P00352 5/20 0.36
LMNA P02545 1/20 0.35
NAAA Q02083 1/20 0.34
TSHR P16473 2/20 0.34
CHRM1 P11229 2/20 0.34
ESR1 P03372 1/20 0.34
SLC6A2 P23975 1/20 0.34
KDR P35968 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
HSD17B10 Q99714 1/20 0.33
CHRM2 P08172 1/20 0.32
CHRM3 P20309 1/20 0.32
ATM Q13315 1/20 0.31

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
SCHEMBL1455849 0.81 HCAR2 (0.40) HCAR2ALDH1A1LMNANAAATSHR
SCHEMBL28388810 0.81 HCAR2 (0.40) HCAR2ALDH1A1LMNANAAATSHR
SCHEMBL6667313 0.81
SCHEMBL9636511 0.81 HCAR2 (0.40) HCAR2ALDH1A1LMNANAAATSHR
SCHEMBL2559952 0.79 OR51E2 (0.40) HCAR2ALDH1A1LMNANAAATSHR
SCHEMBL4714979 0.79 HDAC1 (0.39) HCAR2ALDH1A1LMNANAAATSHR
SCHEMBL28920306 0.79 HCAR2 (0.39) HCAR2ALDH1A1LMNANAAATSHR
SCHEMBL30010351 0.79 HCAR2 (0.39) HCAR2ALDH1A1LMNANAAATSHR
SCHEMBL8925212 0.77 HCAR2 (0.38) HCAR2ALDH1A1LMNANAAATSHR
SCHEMBL2333869 0.77 HCAR2 (0.38) HCAR2ALDH1A1LMNANAAATSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0831767-B1 ALPHA HYDROXYACID ESTERS FOR SKIN AGING YU RUEY J (US) 2004-09-22 EP disclosed
EP-0831767-A4 ALPHA HYDROXYACID ESTERS FOR SKIN AGING YU RUEY J (US) 2000-05-17 EP disclosed
EP-0831767-A1 ALPHA HYDROXYACID ESTERS FOR SKIN AGING Yu, Ruey J., Dr. (US) 1998-04-01 EP disclosed
US-5686489-A TOPICALLY APPLIED TO INDUCE GLYCOSAMINOGLYCAN, PROTEOGLYCAN, COLLAGEN AND ELASTIN BIOSYNTHESIS; WRINKLE RESISTANCE TRISTRATA TECHNOLOGY, INC. (US) 1997-11-11 US disclosed
WO-1996040047-A1 ALPHA HYDROXYACID ESTERS FOR SKIN AGING YU RUEY J (US) 1996-12-19 WO disclosed