SCHEMBL7676844

SCHEMBL7676844

CCCCCCCCCc1cccc(OP(=O)(O)Oc2cccc(CCCCCCCCC)c2CCCCCCCCC)c1CCCCCCCCC

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 3/20 0.50
PTGS2 P35354 2/20 0.49
ALOX5 P09917 1/20 0.49
PPARG P37231 2/20 0.48
THRA P10827 1/20 0.46
THRB P10828 1/20 0.46
LTB4R Q15722 1/20 0.45
LTB4R2 Q9NPC1 1/20 0.45
BID P55957 3/20 0.43
MCL1 Q07820 3/20 0.43
BCL2L1 Q07817 2/20 0.43
BAK1 Q16611 2/20 0.43
KAT8 Q9H7Z6 2/20 0.43
EP300 Q09472 1/20 0.43
KAT2A Q92830 1/20 0.43
KAT2B Q92831 1/20 0.43
KAT5 Q92993 1/20 0.43
SAE1 Q9UBE0 1/20 0.43
LIPG Q9Y5X9 1/20 0.43
ENPP2 Q13822 1/20 0.41

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
SCHEMBL9362261 1.00 PPARA (0.50) PPARAPTGS2ALOX5PPARGTHRA
SCHEMBL17491589 0.92 PLK1 (0.46) PPARAPTGS2ALOX5PPARGTHRA
SCHEMBL7174348 0.92 PPARA (0.47) PPARAPTGS2ALOX5PPARGTHRA
SCHEMBL17512908 0.92 PLK1 (0.46) PPARAPTGS2ALOX5PPARGTHRA
SCHEMBL17491619 0.92 PPARA (0.46) PPARAPTGS2ALOX5PPARGTHRA
SCHEMBL17491596 0.92 PPARA (0.46) PPARAPTGS2ALOX5PPARGTHRA
SCHEMBL8636666 0.92 PPARA (0.46) PPARAPTGS2ALOX5PPARGTHRA
SCHEMBL4440545 0.91 PPARA (0.50) PPARAPTGS2ALOX5PPARGTHRA
SCHEMBL6281614 0.91 PPARA (0.50) PPARAPTGS2ALOX5PPARGTHRA
SCHEMBL4442481 0.91 PPARA (0.50) PPARAPTGS2ALOX5PPARGTHRA

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-6500049-B2 NON-AQUEOUS SOLVENT AND AT LEAST ONE ACETYLENE GLYCOL COMPOUND SUCH AS THE ETHYLENE OXIDE ADDUCT OF 2,4,7,9-TETRAMETHYL-5-DECYN-4,7-DIOL; FINISH GRINDING THIN FILM TYPE MAGNETIC HEAD TOKYO MAGNETIC PRINTING CO., LTD. (JP) 2002-12-31 US disclosed
US-20010009840-A1 Lapping oil composition for finish-grinding TOPPAN TDK LABEL CO., LTD. (JP) 2001-07-26 US disclosed