SCHEMBL11221409

SCHEMBL11221409

CC(C)C(=O)OCC(C)(C)C(OB(OC(C(C)C)C(C)(C)COC(=O)C(C)C)OC(C(C)C)C(C)(C)COC(=O)C(C)C)C(C)C

nearest known ligand 0.34

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.32
POLB P06746 1/20 0.32
MAPT P10636 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
SCHEMBL11216396 0.84 PRKCA (0.35)
SCHEMBL14430386 0.81 ALDH1A1 (0.33) ALDH1A1POLBMAPT
SCHEMBL43993 0.81 ALDH1A1 (0.33) ALDH1A1POLBMAPT
SCHEMBL9975676 0.81 ALDH1A1 (0.33) ALDH1A1POLBMAPT
SCHEMBL29796685 0.81 ALDH1A1 (0.33) ALDH1A1POLBMAPT
SCHEMBL11315933 0.79 TSHR (0.35) ALDH1A1POLBMAPT
SCHEMBL30038608 0.79 ALDH1A1 (0.32) ALDH1A1POLBMAPT
SCHEMBL2945876 0.77 ALDH1A1 (0.31) ALDH1A1POLBMAPT
SCHEMBL9718333 0.75 LMNA (0.39) ALDH1A1POLBMAPT
SCHEMBL11570327 0.73 TSHR (0.40) ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-57162767-A None JP disclosed
JP-S57162767-A THICKENER FOR RESIN EMULSION TOHO CHEM IND CO LTD 1982-10-06 JP disclosed