SCHEMBL28527339

SCHEMBL28527339

O=C1C#CCCCCCCCCCCCC1

nearest known ligand 0.36

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
TRIM24 O15164 2/20 0.36
TRIM33 Q9UPN9 2/20 0.36
ALDH1A1 P00352 1/20 0.36

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
SCHEMBL14163832 1.00 TRIM24 (0.36) TRIM24TRIM33ALDH1A1
SCHEMBL31164819 1.00 TRIM24 (0.36) TRIM24TRIM33ALDH1A1
SCHEMBL23630990 1.00
SCHEMBL17799153 0.97
SCHEMBL483232 0.89
SCHEMBL9450094 0.79
SCHEMBL482887 0.77
SCHEMBL2485364 0.72 TRIM24 (0.65) TRIM24TRIM33ALDH1A1
SCHEMBL17434741 0.72 TRIM24 (0.30) TRIM24TRIM33
SCHEMBL22164273 0.70 TRIM24 (0.61) TRIM24TRIM33ALDH1A1

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-107915610-B Preparation method of cyclopentadecanone 万华化学集团股份有限公司 2021-03-09 CN disclosed