SCHEMBL8053402

SCHEMBL8053402

CCCCCCCCCc1ccccc1OP(=O)(Oc1ccccc1CCCCCCCCC)OP(=O)(O)O

nearest known ligand 0.51

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
THRA P10827 1/20 0.51
THRB P10828 1/20 0.51
PPARA Q07869 2/20 0.46
LIPG Q9Y5X9 1/20 0.45
ALOX5 P09917 1/20 0.44
PTGS2 P35354 1/20 0.44
PPARG P37231 1/20 0.44
CETP P11597 2/20 0.40
S1PR2 O95136 1/20 0.40
S1PR4 O95977 1/20 0.40
S1PR1 P21453 1/20 0.40
S1PR3 Q99500 1/20 0.40
ENPP2 Q13822 1/20 0.40
PLK1 P53350 1/20 0.40
BID P55957 2/20 0.40
BCL2L1 Q07817 2/20 0.40
MCL1 Q07820 2/20 0.40
BAK1 Q16611 2/20 0.40

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
SCHEMBL8058970 1.00 THRA (0.51) THRATHRBPPARALIPGALOX5
SCHEMBL4946875 0.93 THRA (0.45) THRATHRBPPARALIPGALOX5
SCHEMBL18139228 0.88 THRA (0.56) THRATHRBPPARALIPGALOX5
SCHEMBL18140912 0.88 THRA (0.56) THRATHRBPPARALIPGALOX5
SCHEMBL10878272 0.88 THRA (0.56) THRATHRBPPARALIPGALOX5
SCHEMBL18141467 0.88 THRA (0.56) THRATHRBPPARALIPGALOX5
SCHEMBL18141719 0.88 THRA (0.56) THRATHRBPPARALIPGALOX5
SCHEMBL18140210 0.88 THRA (0.56) THRATHRBPPARALIPGALOX5
SCHEMBL248072 0.88 THRA (0.56) THRATHRBPPARALIPGALOX5
SCHEMBL18139782 0.88 THRA (0.56) THRATHRBPPARALIPGALOX5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0635209-B1 AQUATIC PEST CONTROL DRUG ASAHI DENKA KOGYO KK (JP) 2000-05-17 EP disclosed
US-5505770-A CONTAINING AT LEAST ONE ALKYLPHENYL ESTER OF PHOSPHOROUS OR PHOSPHORIC ACID ASAHI DENKA KOGYO KABUSHIKI KAISHA (JP) 1996-04-09 US disclosed
EP-0635209-A1 AQUATIC PEST CONTROL DRUG ASAHI DENKA KOGYO KABUSHIKI KAISHA (JP) 1995-01-25 EP disclosed