SCHEMBL8690451

SCHEMBL8690451

Cl[Pd]Cl.O=P(CCCCP(=O)(Oc1ccccc1)Oc1ccccc1)(Oc1ccccc1)Oc1ccccc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SRC P12931 1/20 0.45
KLK8 O60259 2/20 0.44
PLAU P00749 2/20 0.44
KLK2 P20151 2/20 0.44
KLK4 Q9Y5K2 2/20 0.44
L3MBTL1 Q9Y468 2/20 0.44
TDP1 Q9NUW8 1/20 0.44
BTN3A1 O00481 1/20 0.41
HTT P42858 2/20 0.41
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
KDM4E B2RXH2 1/20 0.40
ALDH1A1 P00352 1/20 0.39
GAA P10253 1/20 0.39
MAPT P10636 1/20 0.39
ALPG P10696 1/20 0.39
ALOX12 P18054 1/20 0.39
NPY1R P25929 1/20 0.39
NPY2R P49146 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39

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
SCHEMBL8370393 0.92 SRC (0.52) SRCKLK8PLAUKLK2KLK4
SCHEMBL2595713 0.90 SRC (0.54) SRCKLK8PLAUKLK2KLK4
Hydrochloric Acid SCHEMBL7526008 0.88 SRC (0.48) SRCKLK8PLAUKLK2KLK4
SCHEMBL1822019 0.83 SRC (0.56) SRCKLK8PLAUKLK2KLK4
SCHEMBL28670781 0.83 KLK8 (0.47) SRCKLK8PLAUKLK2KLK4
SCHEMBL4453721 0.83 SRC (0.48) SRCKLK8PLAUKLK2KLK4
SCHEMBL10632904 0.83 CETP (0.49) L3MBTL1
SCHEMBL11146084 0.82 SRC (0.50) SRCKLK8PLAUKLK2KLK4
SCHEMBL23650048 0.81 CETP (0.51)
SCHEMBL12564833 0.81 CETP (0.51)

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
US-5789436-A ARTERIOSCLEROSIS; INHIBITORS OF OXIDATION OF LOW DENSITY LIPOPROTEINS; CHUGAI SEIYAK KABUSHIKI KAISHA (JP) 1998-08-04 US disclosed