SCHEMBL29715074

SCHEMBL29715074

CCCCCCCCCCCCCCCc1cccc(C(O)(c2cccc(CCCCCCCCCCCCCCC)c2)C(CO)(CO)CO)c1.OP(O)OP(O)O

nearest known ligand 0.47

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
LPL P06858 2/20 0.44
LIPG Q9Y5X9 2/20 0.44
PPARG P37231 5/20 0.43
PPARA Q07869 5/20 0.43
TNNC1 P63316 4/20 0.38
SGPL1 O95470 1/20 0.38
S1PR4 O95977 1/20 0.38
S1PR1 P21453 1/20 0.38
GPR183 P32249 1/20 0.38
CERS2 Q96G23 1/20 0.38
S1PR3 Q99500 1/20 0.38
S1PR5 Q9H228 1/20 0.38

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
SCHEMBL30478421 0.78 S1PR1 (0.38) TNNC1SGPL1S1PR4S1PR1GPR183
SCHEMBL30559801 0.75 TNNC1 (0.55) LPLLIPGTNNC1SGPL1S1PR4
SCHEMBL29353129 0.74 LIPG (0.43) LIPGPPARGPPARATNNC1SGPL1
SCHEMBL4413503 0.74 TNNC1 (0.51) LPLLIPGPPARGPPARATNNC1
SCHEMBL29828702 0.74 LIPG (0.38) LIPGPPARGPPARATNNC1SGPL1
SCHEMBL29366019 0.73 S1PR1 (0.34) TNNC1SGPL1S1PR4S1PR1GPR183
Hydrochloric Acid SCHEMBL25371922 0.73 S1PR1 (0.52) LPLLIPGPPARGPPARATNNC1
SCHEMBL6280362 0.72 LPL (0.54) LPLLIPGPPARGPPARA
SCHEMBL29361527 0.71 CYP2C19 (0.35)
SCHEMBL30987837 0.71 GAA (0.38) TNNC1SGPL1S1PR4S1PR1GPR183

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112126126-B Antioxidant stabilizer composition and polyethylene film material 山东三丰新材料有限公司 2022-06-03 CN claimed
CN-112126126-B Antioxidant stabilizer composition and polyethylene film material 山东三丰新材料有限公司 2022-06-03 CN disclosed
CN-112126126-B Antioxidant stabilizer composition and polyethylene film material 山东三丰新材料有限公司 2022-06-03 CN disclosed