SCHEMBL446429

SCHEMBL446429

CCCCc1ccccc1OP(O)Oc1ccccc1

nearest known ligand 0.45

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
THRA P10827 1/20 0.45
THRB P10828 1/20 0.45
ALOX5 P09917 1/20 0.41
PTGS2 P35354 1/20 0.41
PPARA Q07869 2/20 0.40
LTB4R Q15722 1/20 0.39
LTB4R2 Q9NPC1 1/20 0.39
HRH1 P35367 1/20 0.38
LIPG Q9Y5X9 1/20 0.38
PPARG P37231 1/20 0.38
BCL2L2 Q92843 1/20 0.37
LTA4H P09960 1/20 0.37
LMNA P02545 1/20 0.36

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
SCHEMBL28049793 0.94 THRA (0.52) THRATHRBALOX5PTGS2PPARA
SCHEMBL11227670 0.94 THRA (0.52) THRATHRBALOX5PTGS2PPARA
SCHEMBL449156 0.89 LTB4R (0.44) THRATHRBALOX5PTGS2PPARA
SCHEMBL11604986 0.89 THRA (0.50) THRATHRBALOX5PTGS2PPARA
SCHEMBL10348761 0.87 THRA (0.56) THRATHRBALOX5PTGS2PPARA
SCHEMBL1856295 0.86 THRA (0.40) THRATHRBALOX5PTGS2PPARA
SCHEMBL1021215 0.86 THRA (0.44) THRATHRBALOX5PTGS2PPARA
SCHEMBL8433693 0.86 THRA (0.58) THRATHRBALOX5PTGS2PPARA
SCHEMBL28376630 0.86 THRA (0.58) THRATHRBALOX5PTGS2PPARA
SCHEMBL29778064 0.86 THRA (0.58) THRATHRBALOX5PTGS2PPARA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120065112-A1 LUBRICANT COMPOSITION WITH IMPROVED VARNISH DEPOSIT RESISTANCE EXXONMOBIL RESEARCH AND ENGINEERING COMPANY (US) 2012-03-15 US disclosed