SCHEMBL28883111

SCHEMBL28883111

CCCCCCCCc1cccc(OC(Oc2cccc(CCCCCCCC)c2)C(=O)O)c1

nearest known ligand 0.67

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 8/20 0.67
PPARG P37231 5/20 0.67
CNR1 P21554 1/20 0.50
CNR2 P34972 1/20 0.50
LPL P06858 1/20 0.49
LIPG Q9Y5X9 1/20 0.49
PTGIR P43119 1/20 0.48
HDAC1 Q13547 1/20 0.48
HDAC6 Q9UBN7 1/20 0.48

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
SCHEMBL4810429 0.86 PPARA (0.64) PPARAPPARGCNR1CNR2
SCHEMBL5268705 0.85 PPARA (0.62) PPARAPPARGPTGIR
SCHEMBL28356075 0.84 PPARA (0.64) PPARA
SCHEMBL5167531 0.82 PPARA (0.70) PPARAPPARGCNR1CNR2LPL
SCHEMBL11320810 0.82 PPARA (0.62) PPARAPPARGCNR1CNR2LPL
SCHEMBL238313 0.81 PPARA (0.68) PPARAPPARGCNR1CNR2LPL
SCHEMBL29914202 0.81 PPARA (0.68) PPARAPPARGCNR1CNR2LPL
SCHEMBL29943880 0.81 PPARA (0.68) PPARAPPARGCNR1CNR2LPL
SCHEMBL10736373 0.80 PPARA (0.56) PPARAPPARGCNR1CNR2PTGIR
SCHEMBL1635493 0.80 PPARA (1.00) PPARAPPARGCNR1CNR2PTGIR

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-110799345-A Tamper-resistant media for thermal printing 欧米亚国际集团 2020-02-14 CN disclosed