SCHEMBL29034640

SCHEMBL29034640

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nearest known ligand 0.33

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.33
TSHR P16473 1/20 0.33

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
SCHEMBL29034637 0.90 ALDH1A1 (0.31) ALDH1A1
Acetic Acid SCHEMBL776378 0.81 ALDH1A1 (0.45) ALDH1A1TSHR
SCHEMBL776377 0.81
Propiolic Acid SCHEMBL29034644 0.80 ALDH1A1 (0.36) ALDH1A1TSHR
SCHEMBL775261 0.79
Cyclohexane SCHEMBL29109129 0.74 ALDH1A1 (0.43) ALDH1A1TSHR
Methacrylic Acid SCHEMBL779569 0.74 HSD17B10 (0.42) ALDH1A1TSHR
Acrylic Acid SCHEMBL28992531 0.72 LMNA (0.42) ALDH1A1TSHR
Acetic Acid SCHEMBL28992498 0.71 FFAR3 (0.41) ALDH1A1TSHR
Acetic Acid SCHEMBL29436892 0.71 FFAR3 (0.47)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111108642-B Nonaqueous electrolyte, nonaqueous electrolyte secondary battery, and energy device 三菱化学株式会社 2024-04-02 CN disclosed
CN-117790904-A Nonaqueous electrolyte, nonaqueous electrolyte secondary battery, and energy device 三菱化学株式会社 2024-03-29 CN disclosed
CN-111628217-B Electrolyte for lithium ion secondary battery, and assembly 丰田自动车株式会社 2023-12-15 CN disclosed
CN-111344891-B Nonaqueous electrolyte and energy device using same 三菱化学株式会社 2023-05-02 CN disclosed