SCHEMBL4445998

SCHEMBL4445998

CCCCCCCCCCCCc1cccc(OP(=O)(O)O)c1CCCCCCCCCCCC

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 3/20 0.50
ALOX5 P09917 1/20 0.49
PTGS2 P35354 1/20 0.49
PPARG P37231 2/20 0.48
THRA P10827 1/20 0.46
THRB P10828 1/20 0.46
PLK1 P53350 1/20 0.46
LTB4R Q15722 1/20 0.45
LTB4R2 Q9NPC1 1/20 0.45
HTR2A P28223 1/20 0.44
HTR2C P28335 1/20 0.44
HTR2B P41595 1/20 0.44
INPPL1 O15357 1/20 0.44
INPP5B P32019 1/20 0.44
INPP5A Q14642 1/20 0.44
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

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
SCHEMBL3861458 1.00 PPARA (0.50) PPARAALOX5PTGS2PPARGTHRA
SCHEMBL518009 1.00 PPARA (0.50) PPARAALOX5PTGS2PPARGTHRA
SCHEMBL29790850 1.00 PPARA (0.50) PPARAALOX5PTGS2PPARGTHRA
SCHEMBL30954288 1.00 PPARA (0.50) PPARAALOX5PTGS2PPARGTHRA
SCHEMBL4442481 1.00 PPARA (0.50) PPARAALOX5PTGS2PPARGTHRA
SCHEMBL6445625 1.00 PPARA (0.50) PPARAALOX5PTGS2PPARGTHRA
SCHEMBL6281614 1.00 PPARA (0.50) PPARAALOX5PTGS2PPARGTHRA
SCHEMBL4440545 1.00 PPARA (0.50) PPARAALOX5PTGS2PPARGTHRA
SCHEMBL6285550 1.00 PPARA (0.50) PPARAALOX5PTGS2PPARGTHRA
Hydrogen Sulfide SCHEMBL30931097 0.99 PPARA (0.49) 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 8 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090027586-A1 Thermoplastic Resin Composition, and Liquid Crystal Display Component Thereof or Information Recording Media Component Thereof POLYPLASTICS CO., LTD. (JP) 2009-01-29 US disclosed
EP-1992666-A1 THERMOPLASTIC RESIN COMPOSITION AND LIQUID CRYSTAL DISPLAY PART OR INFORMATION RECORDING MEDIUM PART USING THE COMPOSITION Polyplastics Co., Ltd. (JP) 2008-11-19 EP disclosed
US-6075158-A CATALYTIC REACTING A TRIARYL PHOSPHATE WITH AN ALCOHOL IN THE PRESENCE OF A BASE TO PRODUCE THE PHOSPHATE ESTER PRODUCT GREAT LAKES CHEMICAL CORPORATION (US) 2000-06-13 US disclosed
EP-0775147-B1 TRANSESTERIFICATION PROCESS FMC CORP UK LTD (GB) 1999-12-15 EP disclosed
EP-0775147-A1 TRANSESTERIFICATION PROCESS FMC Corporation (UK) Limited (GB) 1997-05-28 EP disclosed
WO-1996005208-A1 TRANSESTERIFICATION PROCESS FMC CORPORATION (UK) LIMITED (GB) 1996-02-22 WO disclosed
US-4212849-A Simultaneous extraction and recovery of uranium and vanadium from wet process acids KERR-MCGEE CORPORATION (US) 1980-07-15 US disclosed
US-4071610-A TREATMENT WITH PHOSPHONATE, PHOSPHATE, OR PHOSPHORAMIDE, HYDROGENATION, OXIDATION BASF AKTIENGESELLSCHAFT (DT) 1978-01-31 US disclosed