SCHEMBL27959577

SCHEMBL27959577

CC(C)COC(C)(C)CCCC(C)C=O

nearest known ligand 0.32

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 1/20 0.32

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
SCHEMBL27959574 0.84 ALDH1A1 (0.34)
SCHEMBL11864337 0.84 CTSK (0.33)
SCHEMBL27959568 0.82 MEN1 (0.35)
SCHEMBL215483 0.80 CTSK (0.32)
SCHEMBL29619785 0.79 ALDH1A1 (0.41)
SCHEMBL225537 0.79 ALDH1A1 (0.41)
SCHEMBL18678973 0.79 MAPK1 (0.31) MAPK1
SCHEMBL215363 0.78 CTSK (0.36)
SCHEMBL217214 0.76 CTSK (0.36)
SCHEMBL11762792 0.74 TP53 (0.34)

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-103819335-B A kind of preparation method of 2,6-dimethyl-6-alkoxyl group (or hydroxyl) enanthaldehyde NANJING YUNHUA LITAI ENERGY SCIENCE & TECHNOLOGY CO., LTD. (CN) 2016-01-20 CN disclosed
CN-103819335-A Preparation method of 2,6-dimethyl-6-alkyloxy(or hydroxyl)heptaldehyde NANJING YUNHUA LITAI ENERGY SCIENCE & TECHNOLOGY CO LTD 2014-05-28 CN disclosed