SCHEMBL7865591

SCHEMBL7865591

CCCCCCCCCCCCc1ccccc1OC(=O)/C=C/C(=O)O

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
THRA P10827 2/20 0.71
THRB P10828 2/20 0.71
PPARA Q07869 3/20 0.55
PPARG P37231 2/20 0.55
ZDHHC2 Q9UIJ5 1/20 0.49
BID P55957 3/20 0.48
MCL1 Q07820 3/20 0.48
BCL2L1 Q07817 2/20 0.48
BAK1 Q16611 2/20 0.48
KAT8 Q9H7Z6 2/20 0.48
EP300 Q09472 1/20 0.48
KAT2A Q92830 1/20 0.48
KAT2B Q92831 1/20 0.48
KAT5 Q92993 1/20 0.48
SAE1 Q9UBE0 1/20 0.48
ATG4B Q9Y4P1 7/20 0.47
PLA2G1B P04054 6/20 0.47
CYP1A2 P05177 1/20 0.47
TDP1 Q9NUW8 1/20 0.47
RECQL P46063 1/20 0.47

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
SCHEMBL10709452 1.00 THRA (0.71) THRATHRBPPARAPPARGZDHHC2
SCHEMBL10709436 1.00 THRA (0.71) THRATHRBPPARAPPARGZDHHC2
SCHEMBL5134092 1.00 THRA (0.71) THRATHRBPPARAPPARGZDHHC2
SCHEMBL9773379 0.94 THRA (0.79) THRATHRBPPARAPPARGZDHHC2
SCHEMBL11037918 0.94 THRA (0.79) THRATHRBPPARAPPARGZDHHC2
SCHEMBL9773365 0.94 THRA (0.79) THRATHRBPPARAPPARGZDHHC2
SCHEMBL11037912 0.94 THRA (0.79) THRATHRBPPARAPPARGZDHHC2
SCHEMBL5297327 0.88 THRA (0.73) THRATHRBPPARAPPARGZDHHC2
SCHEMBL8522279 0.88 THRA (0.73) THRATHRBPPARAPPARGZDHHC2
SCHEMBL5297313 0.88 THRA (0.73) THRATHRBPPARAPPARGZDHHC2

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
EP-1091987-A1 WAX CRYSTAL MODIFIERS FORMED FROM DIALKYL PHENYL FUMARATE Infineum USA L.P. (US) 2001-04-18 EP disclosed
WO-1999062973-A1 WAX CRYSTAL MODIFIERS FORMED FROM DIALKYL PHENYL FUMARATE INFINEUM USA L.P. (US) 1999-12-09 WO disclosed