SCHEMBL28935403

SCHEMBL28935403

[CH](CC1CCCCC1)C1CCO1

nearest known ligand 0.33

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
ADH1B P00325 1/20 0.31
ADH1C P00326 1/20 0.31
ADH1A P07327 1/20 0.31
ADH4 P08319 1/20 0.31
ADH7 P40394 1/20 0.31

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
SCHEMBL15135399 0.72 HSD11B1 (0.30)
SCHEMBL10528749 0.70 ADH1B (0.36) ADH1BADH1CADH1AADH4ADH7
SCHEMBL4654343 0.70 ADH1B (0.36) ADH1BADH1CADH1AADH4ADH7
SCHEMBL2359513 0.70 ADH1B (0.36) ADH1BADH1CADH1AADH4ADH7
SCHEMBL11407090 0.70 ADH1B (0.36) ADH1BADH1CADH1AADH4ADH7
SCHEMBL3636058 0.70 ADH1B (0.36) ADH1BADH1CADH1AADH4ADH7
SCHEMBL5964129 0.69 CA1 (0.35)
SCHEMBL3137204 0.69 ADH1B (0.39) ADH1BADH1CADH1AADH4ADH7
SCHEMBL4653000 0.67 ADH1B (0.32) ADH1BADH1CADH1AADH4ADH7
SCHEMBL9746728 0.67

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-115279750-A GLP-1 receptor agonist, pharmaceutical composition containing same and preparation method thereof 株式会社LG化学 2022-11-01 CN disclosed