SCHEMBL30883183

SCHEMBL30883183

CC(C)=CCCC(C)CCOC(=O)[C@@H](C)O

nearest known ligand 0.75

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 4/20 0.75
ALDH1A1 P00352 3/20 0.52
NFE2L2 Q16236 1/20 0.44
USP2 O75604 1/20 0.43
EPHX2 P34913 1/20 0.43
TSHR P16473 1/20 0.40
TDP1 Q9NUW8 1/20 0.37
GGPS1 O95749 2/20 0.37
FDPS P14324 2/20 0.37

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
SCHEMBL7048763 1.00 ALOX15 (0.75) ALOX15ALDH1A1NFE2L2USP2EPHX2
SCHEMBL5314344 0.88 ALOX15 (0.77) ALOX15ALDH1A1NFE2L2USP2EPHX2
SCHEMBL133434 0.88 ALOX15 (0.77) ALOX15ALDH1A1NFE2L2USP2EPHX2
Citronellyl Acetate SCHEMBL157075 0.86 ALOX15 (1.00) ALOX15ALDH1A1NFE2L2USP2EPHX2
Citronellyl Acetate SCHEMBL20912959 0.86 ALOX15 (1.00) ALOX15ALDH1A1NFE2L2USP2EPHX2
Citronellyl Acetate SCHEMBL1866109 0.86 ALOX15 (1.00) ALOX15ALDH1A1NFE2L2USP2EPHX2
SCHEMBL6560209 0.86 ALOX15 (0.80) ALOX15ALDH1A1NFE2L2USP2EPHX2
SCHEMBL6951123 0.86 ALOX15 (0.80) ALOX15ALDH1A1NFE2L2USP2EPHX2
SCHEMBL19900228 0.85 ALOX15 (0.73) ALOX15ALDH1A1NFE2L2USP2EPHX2
SCHEMBL8160971 0.85 ALOX15 (0.73) ALOX15ALDH1A1NFE2L2USP2EPHX2

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
EP-4356894-A1 SUSTAINABLE PRODUCT WITH MALODORS Beiersdorf AG (DE) 2024-04-24 EP claimed
EP-4356894-A1 SUSTAINABLE PRODUCT WITH MALODORS Beiersdorf AG (DE) 2024-04-24 EP disclosed