SCHEMBL9019756

SCHEMBL9019756

CC(=O)OCOC(COC(=O)C(C)(C)C)COC(=O)C(C)(C)C

nearest known ligand 0.53

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PRKCA P17252 2/20 0.53
AR P10275 1/20 0.34
ALDH1A1 P00352 1/20 0.32
LMNA P02545 1/20 0.32
HSD17B10 Q99714 1/20 0.32
BTN3A1 O00481 4/20 0.32
TDP1 Q9NUW8 1/20 0.32
PRKCD Q05655 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
SCHEMBL9200185 0.92 PRKCA (0.46) PRKCAAR
SCHEMBL2466001 0.84 TDP1 (0.42) PRKCAARALDH1A1LMNAHSD17B10
SCHEMBL9824006 0.84 PRKCA (0.51) PRKCAALDH1A1LMNAPRKCD
SCHEMBL9463629 0.83 PRKCA (0.55) PRKCAPRKCD
SCHEMBL9128616 0.82 PRKCA (0.50) PRKCAARALDH1A1LMNAHSD17B10
SCHEMBL9019848 0.81 ALDH1A1 (0.47) PRKCAALDH1A1PRKCD
SCHEMBL9001018 0.79 PRKCA (0.70) PRKCAARALDH1A1LMNAHSD17B10
SCHEMBL9463531 0.79 MAPK1 (0.39) PRKCAARALDH1A1LMNAHSD17B10
SCHEMBL8911020 0.78 HTT (0.37) PRKCAARALDH1A1LMNATDP1
SCHEMBL6840326 0.78 ALDH1A1 (0.42) PRKCAALDH1A1LMNAHSD17B10BTN3A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0187297-B1 ALKOXY METHYL ETHER AND ALKOXY METHYL ESTER DERIVATIVES SYNTEX (U.S.A.) INC. (US) 1991-08-21 EP claimed
EP-0187297-A2 Alkoxy methyl ether and alkoxy methyl ester derivatives SYNTEX (U.S.A.) INC. (US) 1986-07-16 EP claimed
JP-7053463-A None JP disclosed
EP-0452680-B1 Substituted purines, process for their preparation and their use as antiviral agents HOECHST AG (DE) 1996-11-06 EP disclosed
JP-H0753463-A ALKOXY METHYL ETHER AND ALKOXY METHYL ESTER DERIVATIVE SYNTEX USA INC 1995-02-28 JP disclosed
EP-0448006-B1 Process for the preparation of acylales HOECHST AG (DE) 1995-01-25 EP disclosed
US-5231221-A PROCESS FOR THE PREPARATION OF ACYLALS HOECHST AKTIENGESELLSCHAFT (DE) 1993-07-27 US disclosed
US-5225590-A Alkoxy methyl ether and alkoxy methyl ester derivatives SYNTEX (U.S.A.) INC. (US) 1993-07-06 US disclosed
EP-0452680-A1 Substituted purines, process for their preparation and their use as antiviral agents HOECHST AKTIENGESELLSCHAFT (DE) 1991-10-23 EP disclosed
EP-0448006-A2 Process for the preparation of acylales HOECHST AKTIENGESELLSCHAFT (DE) 1991-09-25 EP disclosed
EP-0187297-B1 ALKOXY METHYL ETHER AND ALKOXY METHYL ESTER DERIVATIVES SYNTEX (U.S.A.) INC. (US) 1991-08-21 EP disclosed
EP-0187297-A2 Alkoxy methyl ether and alkoxy methyl ester derivatives SYNTEX (U.S.A.) INC. (US) 1986-07-16 EP disclosed