SCHEMBL10322004

SCHEMBL10322004

C=COC(=O)P(=O)(O)OCC

nearest known ligand 0.52

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.41
PPARD Q03181 2/20 0.36
LPAR3 Q9UBY5 4/20 0.34
TP53 P04637 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
CA12 O43570 1/20 0.32
CA1 P00915 1/20 0.32
CA2 P00918 1/20 0.32
CA9 Q16790 1/20 0.32
CYP3A4 P08684 1/20 0.31
CYP2C9 P11712 1/20 0.31
CYP2C19 P33261 1/20 0.31
LPAR2 Q9HBW0 3/20 0.30
LPAR1 Q92633 2/20 0.30

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
SCHEMBL284966 0.82 CA12 (0.41) TSHRPPARDTP53TDP1CA12
Diethyl Hydrogen Phosphate SCHEMBL28083776 0.74 PPARD (0.35) TSHRPPARDLPAR3TP53TDP1
SCHEMBL28798815 0.74 LPAR3 (0.40) TSHRPPARDLPAR3CA12CA1
SCHEMBL3759309 0.74 LAP3 (0.31)
SCHEMBL28323118 0.74 ALDH1A1 (0.42) TSHRPPARDLPAR3TP53TDP1
SCHEMBL11598620 0.74 TSHR (0.42) TSHRPPARDLPAR3TP53TDP1
Diethyl Hydrogen Phosphate SCHEMBL7748470 0.73 TP53 (0.35) TSHRPPARDTP53TDP1CA12
SCHEMBL9113455 0.71 PPARD (0.39) TSHRPPARDLPAR3TP53TDP1
SCHEMBL638866 0.71 PEPD (0.32)
SCHEMBL11333177 0.71 TSHR (0.41) TSHRPPARDTP53TDP1CA12

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
US-20120184653-A1 Synthesis of linear phosphorus-containing functional fluorocopolymer WANG LIANG (US) 2012-07-19 US claimed
US-20120184653-A1 Synthesis of linear phosphorus-containing functional fluorocopolymer WANG LIANG (US) 2012-07-19 US disclosed