SCHEMBL5087200

SCHEMBL5087200

O=P(OCCOCCOP(=O)(Oc1ccccc1)Oc1ccccc1)(Oc1ccccc1)Oc1ccccc1

nearest known ligand 0.65

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PKM P14618 1/20 0.47
SRC P12931 1/20 0.47
MEN1 O00255 2/20 0.46
KMT2A Q03164 2/20 0.46
LMNA P02545 1/20 0.46
L3MBTL1 Q9Y468 2/20 0.45
TDP1 Q9NUW8 1/20 0.45
ELANE P08246 1/20 0.43
ALDH1A1 P00352 1/20 0.42
HTT P42858 1/20 0.42
KDM4E B2RXH2 1/20 0.41
CYP3A4 P08684 1/20 0.39
TSHR P16473 1/20 0.39
CA2 P00918 1/20 0.39

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
SCHEMBL5087201 1.00 PKM (0.47) PKMSRCMEN1KMT2ALMNA
SCHEMBL343402 0.94 SRC (0.52) PKMSRCMEN1KMT2AL3MBTL1
SCHEMBL28639421 0.91 ALDH1A1 (0.44) PKMSRCMEN1KMT2ALMNA
SCHEMBL10614250 0.88 TSHR (0.61) CYP3A4TSHR
SCHEMBL11560936 0.88 TSHR (0.45) PKMSRCMEN1KMT2AL3MBTL1
SCHEMBL11560938 0.86 PKM (0.65) PKMSRCMEN1KMT2AL3MBTL1
SCHEMBL9972155 0.86 CA2 (0.55) PKMSRCMEN1KMT2AL3MBTL1
SCHEMBL3510696 0.86 L3MBTL1 (0.40) PKMMEN1KMT2AL3MBTL1TDP1
SCHEMBL9818167 0.86 SRC (0.48) PKMSRCL3MBTL1TDP1ELANE
SCHEMBL32667934 0.86 SRC (0.48) PKMSRCL3MBTL1TDP1ELANE

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-7407997-B2 Alkyl-aryl oligomeric phosphate ester and polymeric plasticizer blends for vinyl resins SUPRESTA LLC (US) 2008-08-05 US disclosed