SCHEMBL28056007

SCHEMBL28056007

C=CCP(=O)(OC)OC1CCCCC1

nearest known ligand 0.41

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ACHE P22303 1/20 0.41
NPSR1 Q6W5P4 1/20 0.32
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
GAA P10253 1/20 0.30
L3MBTL1 Q9Y468 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
SCHEMBL779830 0.89 ACHE (0.41) ACHENPSR1MEN1KMT2A
SCHEMBL9114848 0.81 ACHE (0.36) ACHEGAA
SCHEMBL575189 0.78 ACHE (0.46) ACHENPSR1MEN1KMT2AGAA
Water SCHEMBL6357544 0.78 ACHE (0.46) ACHENPSR1MEN1KMT2AGAA
Water SCHEMBL6357545 0.78 ACHE (0.46) ACHENPSR1MEN1KMT2AGAA
SCHEMBL575699 0.76 ACHE (0.42) ACHENPSR1MEN1KMT2AGAA
SCHEMBL575240 0.75 ACHE (0.43) ACHENPSR1MEN1KMT2AGAA
SCHEMBL337514 0.74
SCHEMBL575339 0.73 ACHE (0.40) ACHENPSR1MEN1KMT2A
SCHEMBL7409167 0.72

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
CN-103259044-B Nonaqueous electrolyte solution and nonaqueous electrolyte secondary battery MITSUBISHI CHEMICAL CORP. (JP) 2016-02-10 CN disclosed