SCHEMBL8058030

SCHEMBL8058030

O=P(O)(Oc1ccccc1)OP(=O)(Oc1ccccc1)OP(=O)(Oc1ccccc1)Oc1ccccc1

nearest known ligand 0.55

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
SRC P12931 1/20 0.55
KDM4E B2RXH2 1/20 0.44
L3MBTL1 Q9Y468 2/20 0.44
TDP1 Q9NUW8 1/20 0.44
POLB P06746 1/20 0.43
ALDH1A1 P00352 1/20 0.43
CYP2C9 P11712 1/20 0.41
CYP2C19 P33261 1/20 0.41
ANPEP P15144 2/20 0.40
LAP3 P28838 2/20 0.40
CES2 O00748 1/20 0.38
CES1 P23141 1/20 0.38

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
SCHEMBL343723 0.96 SRC (0.59) SRCKDM4EL3MBTL1TDP1POLB
SCHEMBL28203727 0.91 SRC (0.59) SRCKDM4EL3MBTL1TDP1POLB
SCHEMBL9244591 0.90 SRC (0.48) SRCKDM4EL3MBTL1TDP1POLB
SCHEMBL1207088 0.89 SRC (0.52) SRCKDM4EL3MBTL1TDP1POLB
SCHEMBL31037445 0.89 SRC (0.57) SRCKDM4EL3MBTL1TDP1POLB
SCHEMBL8054905 0.88 SRC (0.56) SRCKDM4EL3MBTL1TDP1
SCHEMBL131240 0.87 SRC (0.50) SRCKDM4EL3MBTL1TDP1POLB
SCHEMBL7949659 0.87 SRC (0.50) SRCKDM4EL3MBTL1TDP1POLB
SCHEMBL27950204 0.87 SRC (0.55) SRCKDM4EL3MBTL1TDP1POLB
SCHEMBL27996139 0.86 SRC (0.63) SRCKDM4EL3MBTL1TDP1ALDH1A1

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
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-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