SCHEMBL28515883

SCHEMBL28515883

O=P(CNS(=O)(=O)c1ccc(Cl)cc1)(Oc1ccccc1)Oc1ccccc1

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.63
KMT2A Q03164 4/20 0.63
TP53 P04637 3/20 0.63
GAA P10253 3/20 0.63
PGR P06401 1/20 0.52
ALDH1A1 P00352 3/20 0.49
PRMT1 Q99873 1/20 0.48
AR P10275 1/20 0.47
LMNA P02545 3/20 0.46
SMN1; SMN2 Q16637 2/20 0.46
HTT P42858 1/20 0.46
FLT1 P17948 1/20 0.46
FLT4 P35916 1/20 0.46
KDR P35968 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
CYP19A1 P11511 1/20 0.46
MAPT P10636 3/20 0.45
NPSR1 Q6W5P4 1/20 0.45
XBP1 P17861 1/20 0.45
SGMS1 Q86VZ5 1/20 0.44

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
SCHEMBL11763749 0.86 MEN1 (0.63) MEN1KMT2ATP53GAAALDH1A1
SCHEMBL28510416 0.82 CA2 (0.54) MEN1KMT2AALDH1A1LMNASMN1; SMN2
SCHEMBL28514304 0.75 MEN1 (0.54) MEN1KMT2ATP53GAAPGR
SCHEMBL11764273 0.75 MEN1 (0.56) MEN1KMT2ATP53GAAPGR
SCHEMBL6910975 0.73 CA2 (0.60) MEN1KMT2AALDH1A1FLT1FLT4
SCHEMBL29113251 0.73 TP53 (0.51) MEN1KMT2ATP53GAAPGR
SCHEMBL4419753 0.70 FLT1 (0.52) MEN1KMT2ATP53GAAALDH1A1
SCHEMBL8789480 0.70 CYP19A1 (0.78) MEN1KMT2ATP53GAAALDH1A1
SCHEMBL916422 0.70 KLK8 (0.59) MEN1KMT2ATP53GAAALDH1A1
SCHEMBL4431913 0.70 CYP2D6 (0.46) MEN1KMT2AALDH1A1LMNASMN1; SMN2

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
CN-114409706-A Preparation method of phenyl hydrogen phosphonate and intermediate thereof 上海医药工业研究院 2022-04-29 CN disclosed
CN-112175003-B Preparation method of phenyl hydrogen phosphonate and intermediate thereof 上海医药工业研究院 2022-02-15 CN disclosed
CN-112175003-A Preparation method of phenyl hydrogen phosphonate and intermediate thereof 上海医药工业研究院 2021-01-05 CN disclosed