SCHEMBL11233731

SCHEMBL11233731

C=C(C)C(=O)OCC.O=P(O)(Cl)Cl

nearest known ligand 0.52

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
THRB P10828 1/20 0.52
TSHR P16473 4/20 0.46
ALDH1A1 P00352 7/20 0.44
LMNA P02545 1/20 0.41
HSD17B10 Q99714 1/20 0.41
GLO1 Q04760 1/20 0.41
MGAM O43451 1/20 0.39
GAA P10253 1/20 0.39
SI P14410 1/20 0.39
MGAM2 Q2M2H8 1/20 0.39
MAPT P10636 2/20 0.37
NPSR1 Q6W5P4 1/20 0.36
CYP2D6 P10635 1/20 0.35
CYP2C9 P11712 1/20 0.35
CYP2C19 P33261 1/20 0.35
CASP1 P29466 1/20 0.35
ALOX15 P16050 1/20 0.34

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
Phosphoric Acid SCHEMBL9234978 0.91 THRB (0.55) THRBTSHRALDH1A1LMNAHSD17B10
Phosphoric Acid SCHEMBL9234843 0.91 THRB (0.55) THRBTSHRALDH1A1LMNAHSD17B10
Phosphoric Acid SCHEMBL1100985 0.91 THRB (0.55) THRBTSHRALDH1A1LMNAHSD17B10
Phosphoric Acid SCHEMBL94511 0.91 THRB (0.55) THRBTSHRALDH1A1LMNAHSD17B10
Chloromethane SCHEMBL17453350 0.87 THRB (0.59) THRBTSHRALDH1A1LMNAHSD17B10
SCHEMBL15030 0.87
SCHEMBL19409375 0.87 THRB (0.64) THRBTSHRALDH1A1LMNAHSD17B10
Benzene SCHEMBL95868 0.86 THRB (0.50) THRBTSHRALDH1A1LMNAHSD17B10
Pyrophosphoric Acid SCHEMBL9234839 0.86 THRB (0.50) THRBTSHRALDH1A1LMNAHSD17B10
Phosphoric Acid SCHEMBL16950259 0.86 THRB (0.50) THRBTSHRALDH1A1LMNAHSD17B10

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
CN-102942586-A Preparation method of 2-ethyl methacrylate benzyl phosphate Zhangjiagang shunchang chemical co ltd 2013-02-27 CN disclosed
US-4366299-A Copolymers containing fluorine and their use for the water-repellent and oil-repellent treatment of various substrates P C U K PRODUITS CHIMIQUES UGINE KUHLMANN (FR) 1982-12-28 US disclosed