SCHEMBL18685569

SCHEMBL18685569

CC(=O)OCC(COc1cccc(CCCCCCCCCCCCCC(C)C)c1)OC(C)=O

nearest known ligand 0.45

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ PPARA Q07869 6/20 0.45
▸ PPARG P37231 4/20 0.45
▸ AR P10275 1/20 0.43
▸ MAPK1 P28482 1/20 0.40
▸ L3MBTL1 Q9Y468 1/20 0.40
▸ HDAC1 Q13547 1/20 0.39
▸ HDAC6 Q9UBN7 1/20 0.39
▸ POLB P06746 2/20 0.38
▸ PTGIR P43119 1/20 0.38
▸ MTNR1A P48039 1/20 0.38
▸ MTNR1B P49286 1/20 0.38
▸ FUT7 Q11130 1/20 0.38
▸ KDM4E B2RXH2 1/20 0.38
▸ CYSLTR2 Q9NS75 1/20 0.38
▸ CYSLTR1 Q9Y271 1/20 0.38
▸ CNR1 P21554 1/20 0.37
▸ CNR2 P34972 1/20 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
SCHEMBL17132183 0.81 PPARA (0.50) PPARAPPARGARPTGIRCNR1
SCHEMBL9651352 0.77 PPARA (0.54) PPARAPPARGCNR1CNR2
SCHEMBL9652630 0.74 PPARA (0.48) PPARAPPARGPTGIRCNR1CNR2
SCHEMBL6360882 0.74 AR (0.61) ARPOLBMTNR1AMTNR1BKDM4E
SCHEMBL5616723 0.74 PPARA (0.48) PPARAPPARGMAPK1L3MBTL1HDAC1
SCHEMBL9768064 0.73 PPARA (0.60) PPARAPPARGPTGIRCNR1CNR2
SCHEMBL2328627 0.72 AR (0.54) ARPOLB
SCHEMBL11957636 0.71 POLB (0.55) ARMAPK1L3MBTL1POLBMTNR1A
SCHEMBL27018496 0.71 PPARA (0.48) PPARAPPARGHDAC1HDAC6PTGIR
SCHEMBL10809673 0.71 PPARA (0.47) PPARAPPARGCNR1CNR2

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
US-20200095457-A1 POLYESTER COATING COMPOSITIONS CONTAINING POLYMERS DERIVED FROM CYCLIC CARBONATES SWIMC LLC (US) 2020-03-26 — — US disclosed
US-20170088745-A1 POLYESTER COATING COMPOSITIONS CONTAINING POLYMERS DERIVED FROM CYCLIC CARBONATES VALSPAR SOURCING, INC. (US) 2017-03-30 — — US disclosed
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