SCHEMBL28468635

SCHEMBL28468635

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nearest known ligand 0.30

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 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
SCHEMBL779463 0.94
SCHEMBL28914243 0.83 FFAR3 (0.31)
SCHEMBL28411129 0.83 ALDH1A1 (0.30) ALDH1A1
SCHEMBL775163 0.79 ALDH1A1 (0.36) ALDH1A1
SCHEMBL779353 0.79 ALDH1A1 (0.32) ALDH1A1
SCHEMBL28992488 0.78
Propiolic Acid SCHEMBL28402432 0.76
Acetic Acid SCHEMBL25408794 0.75 FFAR3 (0.37) ALDH1A1
SCHEMBL13117376 0.75 ALDH1A1 (0.42) ALDH1A1
Acetic Acid SCHEMBL25407380 0.72 FFAR3 (0.39) 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
CN-111628217-A Electrolyte for lithium ion secondary battery, and module 丰田自动车株式会社 2020-09-04 CN disclosed
CN-111344891-A Nonaqueous electrolyte solution and energy device using same 三菱化学株式会社 2020-06-26 CN disclosed