Erucic Acid

Erucic Acid

SCHEMBL28429246

CCCCCCCC/C=C\CCCCCCCCCCCC(=O)O.O=C(O)c1ccccc1C(=O)O

nearest known ligand 0.70

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Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PPARG P37231 6/20 0.70
PPARD Q03181 6/20 0.70
PPARA Q07869 6/20 0.70
F7 P08709 6/20 0.70
F3 P13726 6/20 0.70
TERT O14746 3/20 0.70
PTPN1 P18031 3/20 0.70
HSD17B10 Q99714 3/20 0.70
FABP4 P15090 3/20 0.70
PTGS1 P23219 3/20 0.70
MAPT P10636 2/20 0.70
BLM P54132 2/20 0.70
LMNA P02545 2/20 0.70
ALOX15 P16050 2/20 0.70
DUSP3 P51452 2/20 0.70
CYP19A1 P11511 2/20 0.70
NR4A2 P43354 2/20 0.70
SIRT6 Q8N6T7 2/20 0.70
PTPN7 P35236 2/20 0.70
TDP1 Q9NUW8 2/20 0.70

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
Oleic Acid SCHEMBL15209668 1.00 PPARG (0.70) PPARGPPARDPPARAF7F3
Oleic Acid SCHEMBL15209670 1.00 PPARG (0.70) PPARGPPARDPPARAF7F3
Oleic Acid SCHEMBL16861919 0.92 PPARG (0.62) PPARGPPARDPPARAF7F3
Oleic Acid SCHEMBL16861921 0.92 PPARG (0.62) PPARGPPARDPPARAF7F3
Phthalic Acid SCHEMBL2552832 0.91 GPR84 (0.63) PPARGPPARDPPARAPTPN1HSD17B10
Dodecanoate SCHEMBL583704 0.91 GPR84 (0.63) PPARGPPARDPPARAPTPN1HSD17B10
Stearic Acid SCHEMBL30439126 0.91 GPR84 (0.63) PPARGPPARDPPARAPTPN1HSD17B10
Stearic Acid SCHEMBL1446708 0.91 GPR84 (0.63) PPARGPPARDPPARAPTPN1HSD17B10
Oleic Acid SCHEMBL27902290 0.90 PPARG (0.60) PPARGPPARDPPARAF7F3
Oleic Acid SCHEMBL10539872 0.90 PPARG (0.56) PPARGPPARDPPARAF7F3

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-111468032-B Easily soluble/cleavable/self-thickening surfactant and preparation method thereof 江南大学 2021-03-26 CN disclosed
CN-111468032-A Easily soluble/cleavable/self-thickening surfactant and preparation method thereof 江南大学 2020-07-31 CN disclosed