SCHEMBL31175366

SCHEMBL31175366

CCCCC/C=C\C/C=C\CCCCCCC(CC)(C(=O)O)C(C)C

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.53
PPARG P37231 5/20 0.53
KDM4E B2RXH2 4/20 0.53
F7 P08709 4/20 0.53
F3 P13726 4/20 0.53
PPARD Q03181 4/20 0.53
PPARA Q07869 4/20 0.53
FFAR1 O14842 3/20 0.53
LMNA P02545 2/20 0.53
CYP3A4 P08684 2/20 0.53
CYP19A1 P11511 2/20 0.53
FABP4 P15090 2/20 0.53
HPGD P15428 2/20 0.53
ALOX15 P16050 2/20 0.53
PTGS1 P23219 2/20 0.53
AKR1C3 P42330 2/20 0.53
NR4A2 P43354 2/20 0.53
HSD17B10 Q99714 2/20 0.53
TDP1 Q9NUW8 2/20 0.53
FABP3 P05413 2/20 0.53

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
SCHEMBL11589986 0.84 CES2 (0.37) ALDH1A1PPARGPPARDPPARAFFAR1
SCHEMBL9228241 0.82 ALDH1A1 (0.55) ALDH1A1PPARGKDM4EF7F3
SCHEMBL5445954 0.79 CA2 (0.33) FFAR1
SCHEMBL5051330 0.79 ALDH1A1 (0.58) ALDH1A1PPARGKDM4EF7F3
SCHEMBL10942318 0.79 ALDH1A1 (0.51) ALDH1A1PPARGKDM4EF7F3
SCHEMBL17743991 0.79 ALDH1A1 (0.62) ALDH1A1PPARGKDM4EF7F3
SCHEMBL28846614 0.79 ALDH1A1 (0.62) ALDH1A1PPARGKDM4EF7F3
SCHEMBL2635349 0.79 ALDH1A1 (0.62) ALDH1A1PPARGKDM4EF7F3
SCHEMBL28935969 0.79 ALDH1A1 (0.62) ALDH1A1PPARGKDM4EF7F3
SCHEMBL8979994 0.78 TERT (0.49) PPARGF7F3PPARDPPARA

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-118871549-A Emulsifying composition 好侍健康食品株式会社 2024-10-29 CN disclosed