SCHEMBL27939729

SCHEMBL27939729

CCOP(C)(=O)CCC(=O)OC

nearest known ligand 0.46

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
TSHR P16473 5/20 0.46
PPARD Q03181 2/20 0.38
KMT2A Q03164 2/20 0.36
MEN1 O00255 1/20 0.36
CA12 O43570 3/20 0.36
CA1 P00915 1/20 0.36
CA2 P00918 1/20 0.36
CA9 Q16790 1/20 0.36
LMNA P02545 2/20 0.35
CA14 Q9ULX7 2/20 0.35
KDM4E B2RXH2 1/20 0.35
ALDH1A1 P00352 2/20 0.34
HSD17B10 Q99714 2/20 0.34
MAPT P10636 1/20 0.34
HTT P42858 1/20 0.34
MGAM O43451 1/20 0.33
GAA P10253 1/20 0.33
SI P14410 1/20 0.33
MGAM2 Q2M2H8 1/20 0.33

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
SCHEMBL11025207 0.84 CYP1A2 (0.44) TSHRPPARDLMNAALDH1A1MGAM
SCHEMBL734947 0.82 PPARD (0.54) TSHRPPARDKMT2AMEN1CA12
SCHEMBL2984744 0.81 TSHR (0.52) TSHRKMT2AMEN1CA12LMNA
SCHEMBL9945634 0.79 PPARD (0.40) TSHRPPARDKMT2AMEN1CA12
SCHEMBL28231972 0.79 PPARD (0.40) TSHRPPARDCA12CA1CA2
SCHEMBL12405369 0.79 POLB (0.40) TSHRPPARDCA12CA1CA2
SCHEMBL2994652 0.78 TSHR (0.44) TSHRPPARDKMT2AMEN1CA12
SCHEMBL9945633 0.78 ALDH1A1 (0.39) TSHRPPARDLMNAALDH1A1HSD17B10
SCHEMBL2990301 0.76 TSHR (0.57) TSHRKMT2AMEN1CA12LMNA
SCHEMBL11023580 0.76 PPARD (0.38) TSHRPPARDCA12CA1CA2

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-103342718-B A kind of 3-(methyl alkoxy phosphoryl) preparation method of propionic acid ester compound CHONGQING UNISPLENDOUR CHEMICAL CO., LTD. (CN) 2016-02-03 CN disclosed
CN-103342718-A Method for preparing 3-(methyl alkoxy phosphoryl group) propionate compound CHONGQING UNISPLENDOUR CHEM CO 2013-10-09 CN disclosed