SCHEMBL29267239

SCHEMBL29267239

O=P(Cc1ccc(F)cc1)(Oc1ccccc1)Oc1ccccc1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KLK8 O60259 2/20 0.59
PLAU P00749 2/20 0.59
KLK2 P20151 2/20 0.59
KLK4 Q9Y5K2 2/20 0.59
HPGD P15428 2/20 0.45
MAPT P10636 1/20 0.44
NPSR1 Q6W5P4 1/20 0.44
SRC P12931 1/20 0.42
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
HTT P42858 1/20 0.42
LMNA P02545 1/20 0.41
RXFP1 Q9HBX9 1/20 0.41
L3MBTL1 Q9Y468 2/20 0.41
TDP1 Q9NUW8 1/20 0.41
LTA4H P09960 2/20 0.40
EPHX2 P34913 2/20 0.40
NR4A2 P43354 1/20 0.39
ANPEP P15144 1/20 0.38
LAP3 P28838 1/20 0.38

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
SCHEMBL563232 0.87 KLK8 (0.63) KLK8PLAUKLK2KLK4HPGD
SCHEMBL4231397 0.82 KLK8 (0.59) KLK8PLAUKLK2KLK4HPGD
SCHEMBL916422 0.82 KLK8 (0.59) KLK8PLAUKLK2KLK4HPGD
SCHEMBL28701098 0.81 KLK8 (0.57) KLK8PLAUKLK2KLK4HPGD
SCHEMBL916048 0.81 KLK8 (0.57) KLK8PLAUKLK2KLK4HPGD
SCHEMBL24795803 0.79 LTA4H (0.40) KLK8PLAUKLK2KLK4HPGD
SCHEMBL6766317 0.79 KLK8 (0.55) KLK8PLAUKLK2KLK4HPGD
SCHEMBL21840449 0.78 KLK8 (0.55) KLK8PLAUKLK2KLK4SRC
SCHEMBL13538167 0.77 KLK8 (0.54) KLK8PLAUKLK2KLK4MAPT
SCHEMBL17923914 0.76 KLK8 (0.53) KLK8PLAUKLK2KLK4HPGD

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
CN-114031639-B Preparation method of biphospide with P-O-C-P structure 烟台大学 2024-07-12 CN disclosed