SCHEMBL17512908

SCHEMBL17512908

CCCCCCCCc1cccc(OP(=O)(O)Oc2cccc(OP(=O)(O)Oc3cccc(CCCCCCCC)c3CCCCCCCC)c2)c1CCCCCCCC

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PLK1 P53350 1/20 0.46
PPARA Q07869 4/20 0.44
ALOX5 P09917 1/20 0.43
PTGS2 P35354 1/20 0.43
PPARG P37231 3/20 0.43
THRA P10827 1/20 0.41
THRB P10828 1/20 0.41
CETP P11597 1/20 0.41
LTB4R Q15722 1/20 0.41
LTB4R2 Q9NPC1 1/20 0.41
GGPS1 O95749 1/20 0.39
BID P55957 3/20 0.39
MCL1 Q07820 3/20 0.39
BCL2L1 Q07817 2/20 0.39
BAK1 Q16611 2/20 0.39
KAT8 Q9H7Z6 2/20 0.39
EP300 Q09472 1/20 0.39
KAT2A Q92830 1/20 0.39
KAT2B Q92831 1/20 0.39
KAT5 Q92993 1/20 0.39

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
SCHEMBL17491589 1.00 PLK1 (0.46) PLK1PPARAALOX5PTGS2PPARG
SCHEMBL17491617 0.95 PLK1 (0.40) PLK1PPARAALOX5PTGS2PPARG
SCHEMBL7174348 0.93 PPARA (0.47) PLK1PPARAALOX5PTGS2PPARG
SCHEMBL9362261 0.92 PPARA (0.50) PLK1PPARAALOX5PTGS2PPARG
SCHEMBL7676844 0.92 PPARA (0.50) PLK1PPARAALOX5PTGS2PPARG
Phosphoric Acid SCHEMBL28098228 0.92 PPARA (0.46) PLK1PPARAALOX5PTGS2PPARG
SCHEMBL381498 0.88 LTB4R (0.42) PPARAALOX5PTGS2PPARGTHRA
SCHEMBL8636666 0.85 PPARA (0.46) PLK1PPARAALOX5PTGS2PPARG
SCHEMBL17491596 0.85 PPARA (0.46) PPARAALOX5PTGS2PPARGTHRA
SCHEMBL17491619 0.85 PPARA (0.46) PPARAALOX5PTGS2PPARGTHRA

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-10301547-B2 Flame retardant composition, flame retardant fiber treated with flame retardant composition, and method for increasing amount of flame retardant component adhered onto fibers using said composition ADEKA CORPORATION (JP) 2019-05-28 US disclosed
US-20160053179-A1 FLAME RETARDANT COMPOSITION, FLAME RETARDANT FIBER TREATED WITH FLAME RETARDANT COMPOSITION, AND METHOD FOR INCREASING AMOUNT OF FLAME RETARDANT COMPONENT ADHERED ONTO FIBERS USING SAID COMPOSITION ADEKA CORPORATION (JP) 2016-02-25 US disclosed