SCHEMBL29406337

SCHEMBL29406337

CCCCCC(CC)(CCCCC)C(C)=O

nearest known ligand 0.42

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CYP4F2 P78329 1/20 0.42
CYP4A11 Q02928 1/20 0.42
CES2 O00748 3/20 0.42
FDPS P14324 10/20 0.40
GGPS1 O95749 7/20 0.40
CES1 P23141 1/20 0.39

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
SCHEMBL2709008 0.98 CES2 (0.45) CYP4F2CYP4A11CES2FDPSGGPS1
SCHEMBL5171452 0.98 CES2 (0.45) CYP4F2CYP4A11CES2FDPSGGPS1
SCHEMBL5030363 0.96 CES2 (0.44) CYP4F2CYP4A11CES2FDPSGGPS1
SCHEMBL5032181 0.94 CES2 (0.42) CYP4F2CYP4A11CES2FDPSGGPS1
SCHEMBL6918609 0.93 CES2 (0.45) CYP4F2CYP4A11CES2FDPSGGPS1
Water SCHEMBL28107958 0.91 CYP4F2 (0.40) CYP4F2CYP4A11CES2FDPSGGPS1
SCHEMBL14986189 0.88 CYP4F2 (0.39) CYP4F2CYP4A11CES2FDPSCES1
SCHEMBL4361811 0.88 CES2 (0.48) CES2FDPSGGPS1CES1
Acetone SCHEMBL5983365 0.86 CES2 (0.47) CES2FDPSGGPS1CES1
Acetone SCHEMBL10601124 0.86 CES2 (0.47) CES2FDPSGGPS1CES1

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-111417373-B Hair dyeing composition comprising microcapsules 弗门尼舍有限公司 2024-04-12 CN disclosed
CN-114096651-A Perfumed consumer product 弗门尼舍有限公司 2022-02-25 CN disclosed