Acetic Acid Phenyl Ester

Acetic Acid Phenyl Ester

SCHEMBL8081079

CC(=O)Oc1cc2c3cc(OC(C)=O)c(OC(C)=O)cc3c3cc(OC(C)=O)c(OC(C)=O)cc3c2cc1OC(C)=O.CC(=O)Oc1ccccc1

nearest known ligand 0.56

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Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ELANE P08246 1/20 0.56
MAPT P10636 3/20 0.54
MAPK1 P28482 1/20 0.54
ALDH1A1 P00352 3/20 0.53
GAA P10253 3/20 0.53
HSP90AA1 P07900 1/20 0.53
KDM4E B2RXH2 4/20 0.52
LMNA P02545 4/20 0.52
TSHR P16473 2/20 0.52
TDP1 Q9NUW8 2/20 0.52
HSD17B10 Q99714 2/20 0.52
CYP3A4 P08684 1/20 0.52
ESR1 P03372 1/20 0.52
ITGB3 P05106 1/20 0.52
ITGA2B P08514 1/20 0.52
HMGB1 P09429 1/20 0.52
HPGD P15428 1/20 0.52
GGT1 P19440 1/20 0.52
PTGS1 P23219 1/20 0.52
PTGS2 P35354 1/20 0.52

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
Acetic Acid Phenyl Ester SCHEMBL35500 0.85 ELANE (0.72) ELANEMAPTALDH1A1GAAHSP90AA1
Acetic Acid Phenyl Ester SCHEMBL6422166 0.85 ELANE (0.72) ELANEMAPTALDH1A1GAAHSP90AA1
Phenol SCHEMBL8086399 0.85 KDM4E (0.52) ELANEMAPTMAPK1ALDH1A1GAA
Acetic Acid Phenyl Ester SCHEMBL8080259 0.84 ELANE (0.64) ELANEMAPTMAPK1ALDH1A1GAA
Acetic Acid Phenyl Ester SCHEMBL388843 0.83 ELANE (0.69) ELANEMAPTALDH1A1GAAHSP90AA1
Acetic Acid Phenyl Ester SCHEMBL1309661 0.83 ELANE (0.69) ELANEMAPTALDH1A1GAAHSP90AA1
Acetic Acid Phenyl Ester SCHEMBL181469 0.83 ELANE (0.69) ELANEMAPTALDH1A1GAAHSP90AA1
Acetic Acid Phenyl Ester SCHEMBL11787346 0.83 ELANE (0.69) ELANEMAPTALDH1A1GAAHSP90AA1
Acetic Acid Phenyl Ester SCHEMBL4343067 0.83 ELANE (0.69) ELANEMAPTALDH1A1GAAHSP90AA1
Acetic Acid Phenyl Ester SCHEMBL11483885 0.83 ELANE (0.69) ELANEMAPTALDH1A1GAAHSP90AA1

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-0758013-B1 Liquid crystalline optical film, compensating film for liquid crystal display and liquid crystal display NIPPON OIL CO LTD (JP) 2000-10-11 EP disclosed
US-5855971-A Liquid crystalline optical film, compensating film for liquid crystal display comprising the liquid crystalline optical film, and liquid crystal display having the compensating film NIPPON OIL COMPANY, LIMITED (JP) 1999-01-05 US disclosed
EP-0758013-A1 Liquid crystalline optical film, compensating film for liquid crystal display and liquid crystal display NIPPON OIL COMPANY, LIMITED (JP) 1997-02-12 EP disclosed