SCHEMBL8436725

SCHEMBL8436725

CCOC(=O)C(=O)OOC

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.46
LMNA P02545 1/20 0.43
HSD17B10 Q99714 1/20 0.43
NPSR1 Q6W5P4 1/20 0.43
GLO1 Q04760 1/20 0.43
GAA P10253 2/20 0.42
ALOX15 P16050 1/20 0.42
MGAM O43451 1/20 0.42
SI P14410 1/20 0.42
MGAM2 Q2M2H8 1/20 0.42
SOAT1 P35610 1/20 0.42
TSHR P16473 1/20 0.41
EGLN1 Q9GZT9 1/20 0.40
MAPT P10636 1/20 0.39
TRPA1 O75762 1/20 0.39
CYP2D6 P10635 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
CYP2C9 P11712 1/20 0.35

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
SCHEMBL11763231 0.83 ALDH1A1 (0.50) ALDH1A1LMNAHSD17B10NPSR1GLO1
SCHEMBL9823358 0.83 ALDH1A1 (0.62) ALDH1A1LMNAHSD17B10NPSR1GLO1
SCHEMBL7262 0.83 ALDH1A1 (0.62) ALDH1A1LMNAHSD17B10NPSR1GLO1
SCHEMBL1331989 0.83 ALDH1A1 (0.62) ALDH1A1LMNAHSD17B10NPSR1GLO1
SCHEMBL28365143 0.81 ALDH1A1 (0.46) ALDH1A1LMNAHSD17B10NPSR1GLO1
Ammonia Solution, Strong SCHEMBL12803984 0.80 ALDH1A1 (0.59) ALDH1A1LMNAHSD17B10NPSR1GLO1
SCHEMBL28824460 0.80 ALDH1A1 (0.59) ALDH1A1LMNAHSD17B10NPSR1GLO1
SCHEMBL9751764 0.80 ALDH1A1 (0.59) ALDH1A1LMNAHSD17B10NPSR1GLO1
SCHEMBL28251428 0.80 ALDH1A1 (0.59) ALDH1A1LMNAHSD17B10NPSR1GLO1
SCHEMBL30076441 0.80 ALDH1A1 (0.59) ALDH1A1LMNAHSD17B10NPSR1GLO1

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-0728315-B1 PHOTOCHROMIC COMPOSITIONS OF IMPROVED FATIGUE RESISTANCE PPG IND OHIO INC (US) 1999-12-22 EP disclosed
EP-0728315-A1 PHOTOCHROMIC COMPOSITIONS OF IMPROVED FATIGUE RESISTANCE PPG INDUSTRIES, INC. (US) 1996-08-28 EP disclosed
EP-0728315-A4 PHOTOCHROMIC COMPOSITIONS OF IMPROVED FATIGUE RESISTANCE PPG INDUSTRIES INC (US) 1995-11-23 EP disclosed
US-5391327-A Includes hindered amine ligth stabilizer and asymmetric diaryloxalamide light stabilizer TRANSITIONS OPTICAL, INC. (US) 1995-02-21 US disclosed
WO-1994008260-A1 PHOTOCHROMIC COMPOSITIONS OF IMPROVED FATIGUE RESISTANCE PPG INDUSTRIES, INC. (US) 1994-04-14 WO disclosed