SCHEMBL783556

SCHEMBL783556

CCC(=O)OC(C)(OC)OC

nearest known ligand 0.35

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.35
NAAA Q02083 1/20 0.32
TDP1 Q9NUW8 3/20 0.32
TSHR P16473 2/20 0.32
FFAR3 O14843 1/20 0.30
DGAT1 O75907 1/20 0.30
GAA P10253 1/20 0.30

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
SCHEMBL29044089 0.87 ALDH1A1 (0.39) ALDH1A1NAAATDP1TSHRFFAR3
SCHEMBL6276294 0.82 TSHR (0.39) ALDH1A1TSHRDGAT1GAA
SCHEMBL11720051 0.82 TSHR (0.46) ALDH1A1TSHRDGAT1GAA
SCHEMBL783992 0.81 ALDH1A1 (0.48) ALDH1A1TSHRFFAR3
SCHEMBL3164866 0.80 TSHR (0.32) TSHRDGAT1GAA
SCHEMBL28299790 0.78 ALDH1A1 (0.33) ALDH1A1NAAAGAA
SCHEMBL610468 0.78 TSHR (0.44) ALDH1A1TSHRGAA
SCHEMBL10918514 0.78 TSHR (0.50) ALDH1A1TSHR
SCHEMBL12259746 0.77
SCHEMBL784518 0.77 ALDH1A1 (0.36) ALDH1A1NAAATDP1TSHRFFAR3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120070730-A1 NONAQUEOUS ELECTROLYTE AND NONAQUEOUS ELECTROLYTE BATTERY SONY CORPORATION (JP) 2012-03-22 US disclosed