SCHEMBL2137158

SCHEMBL2137158

CCCCC(C)(CCC(=O)O)C(=O)O

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AKR1B1 P15121 1/20 0.48
GPR84 Q9NQS5 7/20 0.46
PPARG P37231 7/20 0.46
PPARD Q03181 7/20 0.46
PPARA Q07869 7/20 0.46
HDAC11 Q96DB2 5/20 0.46
TSHR P16473 5/20 0.46
PTPN1 P18031 3/20 0.46
ALDH1A1 P00352 3/20 0.46
KMT2A Q03164 3/20 0.46
TLR2 O60603 2/20 0.46
TDP1 Q9NUW8 2/20 0.46
FABP4 P15090 2/20 0.46
MEN1 O00255 2/20 0.46
HSD17B10 Q99714 2/20 0.46
SLC22A6 Q4U2R8 1/20 0.46
SLC22A8 Q8TCC7 1/20 0.46
ESR1 P03372 1/20 0.46
ALOX15 P16050 1/20 0.46
PDE4A P27815 1/20 0.46

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
SCHEMBL2139329 0.92 AKR1B1 (0.54) AKR1B1GPR84PPARGPPARDPPARA
SCHEMBL4367663 0.90 AKR1B1 (0.58) AKR1B1GPR84PPARGPPARDPPARA
SCHEMBL2201929 0.89 TSHR (0.46) AKR1B1GPR84PPARGPPARDPPARA
SCHEMBL30219827 0.87 TSHR (0.46) AKR1B1GPR84PPARGPPARDPPARA
SCHEMBL9175772 0.87 TSHR (0.44) AKR1B1GPR84PPARGPPARDPPARA
SCHEMBL9179888 0.87 TSHR (0.44) AKR1B1GPR84PPARGPPARDPPARA
SCHEMBL9178193 0.87 TSHR (0.44) AKR1B1GPR84PPARGPPARDPPARA
SCHEMBL11307948 0.87 TSHR (0.55) AKR1B1GPR84TSHRALDH1A1KMT2A
SCHEMBL9179933 0.85 TDP1 (0.43) GPR84PPARGPPARDPPARAHDAC11
SCHEMBL11596995 0.85 TSHR (0.42) AKR1B1GPR84PPARGPPARDPPARA

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 15 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7862749-B2 Flame retardant polyurethanes and additives therefor ALBEMARLE CORPORATION (US) 2011-01-04 US disclosed
EP-2107079-A2 Flame retardants with high halogen content and low viscosity Albermarle Corporation (US) 2009-10-07 EP disclosed
EP-1664179-B1 FLAME RETARDANTS WITH HIGH HALOGEN CONTENT AND LOW VISCOSITY ALBEMARLE CORP (US) 2009-07-15 EP disclosed
US-7381354-B2 Flame retardants with high halogen content and low viscosity ALBEMARLE CORPORATION (US) 2008-06-03 US disclosed
US-20070276055-A1 Flame Retardant Polyurethanes and Additives Therefor ALBEMARLE CORPORATION (US) 2007-11-29 US disclosed
EP-1756224-B1 FLAME RETARDANT POLYURETHANES AND ADDITIVES THEREFOR ALBEMARLE CORP (US) 2007-10-17 EP disclosed
US-20070225517-A1 Flame Retardants With High Halogen Content and Low Viscosity ALBEMARLE CORPORATION (US) 2007-09-27 US disclosed
US-7258823-B2 Flame retardants with high halogen content and low viscosity ALBEMARLE CORPORATION (US) 2007-08-21 US disclosed
EP-1756224-A1 FLAME RETARDANT POLYURETHANES AND ADDITIVES THEREFOR ALBEMARLE CORPORATION (US) 2007-02-28 EP disclosed
EP-1664179-A1 FLAME RETARDANTS WITH HIGH HALOGEN CONTENT AND LOW VISCOSITY ALBEMARLE CORPORATION (US) 2006-06-07 EP disclosed
US-7045564-B2 Flame retardants with high halogen content and low viscosity ALBEMARLE CORPORATION (US) 2006-05-16 US disclosed
WO-2005118720-A1 FLAME RETARDANT POLYURETHANES AND ADDITIVES THEREFOR ALBEMARLE CORPORATION (US) 2005-12-15 WO disclosed
WO-2005023927-A1 FLAME RETARDANTS WITH HIGH HALOGEN CONTENT AND LOW VISCOSITY ALBEMARLE CORPORATION (US) 2005-03-17 WO disclosed
US-20050045857-A1 Flame retardants with high halogen content and low viscosity ALBEMARLE CORPORATION 2005-03-03 US disclosed
US-20050045858-A1 Flame retardants with high halogen content and low viscosity ALBEMARLE CORPORATION 2005-03-03 US disclosed