SCHEMBL846360

SCHEMBL846360

O=P(O)(O)c1ccccc1P

nearest known ligand 0.54

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CA2 P00918 1/20 0.44
CA4 P22748 1/20 0.44
CA5A P35218 1/20 0.44
PTK2B Q14289 5/20 0.44
POLB P06746 3/20 0.44
NPC1 O15118 2/20 0.44
ALDH1A1 P00352 1/20 0.42
RAB9A P51151 1/20 0.42
ALPG P10696 1/20 0.41
KDM4E B2RXH2 1/20 0.37
RXFP1 Q9HBX9 1/20 0.37
MAPT P10636 1/20 0.36
SRC P12931 2/20 0.34
CFTR P13569 1/20 0.34
FDPS P14324 1/20 0.34
PTPN1 P18031 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
SCHEMBL2173729 0.81 CA2 (0.55) CA2CA4CA5APTK2BPOLB
SCHEMBL29733396 0.81 CA2 (0.55) CA2CA4CA5APTK2BPOLB
SCHEMBL4956835 0.74 CA2 (0.48) CA2CA4CA5APTK2BPOLB
SCHEMBL1227487 0.72 CYP3A4 (0.52) CA2CA4CA5APTK2BPOLB
SCHEMBL343451 0.70 CA2 (0.44) CA2CA4CA5APTK2BPOLB
SCHEMBL3854285 0.70 CA2 (0.44) CA2CA4CA5APTK2BPOLB
SCHEMBL3889145 0.70 CA2 (0.44) CA2CA4CA5APTK2BPOLB
SCHEMBL3365510 0.70 CA2 (0.44) CA2CA4CA5APTK2BPOLB
SCHEMBL7812902 0.70 CA2 (0.44) CA2CA4CA5APTK2BPOLB
SCHEMBL11350253 0.70 CYP3A4 (0.50) CA2CA4CA5APTK2BPOLB

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 11 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2303903-B1 CLAY ACTIVATION OF PD(II) AND NI(II) COMPLEXES UNIV CALIFORNIA (US) 2016-11-16 EP claimed
US-8268946-B2 Clay activation of PD(II) and NI(II) complexes THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2012-09-18 US claimed
JP-2011525211-A 2011-09-15 JP claimed
EP-2303903-A1 CLAY ACTIVATION OF PD(II) AND NI(II) COMPLEXES The Regents of the University of California (US) 2011-04-06 EP claimed
US-20090326174-A1 CLAY ACTIVATION OF PD(II) AND NI(II) COMPLEXES THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2009-12-31 US claimed
WO-2009155509-A1 CLAY ACTIVATION OF PD(II) AND NI(II) COMPLEXES THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2009-12-23 WO claimed
EP-2303903-B1 CLAY ACTIVATION OF PD(II) AND NI(II) COMPLEXES UNIV CALIFORNIA (US) 2016-11-16 EP disclosed
US-8268946-B2 Clay activation of PD(II) and NI(II) complexes THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2012-09-18 US disclosed
EP-2303903-A1 CLAY ACTIVATION OF PD(II) AND NI(II) COMPLEXES The Regents of the University of California (US) 2011-04-06 EP disclosed
US-20090326174-A1 CLAY ACTIVATION OF PD(II) AND NI(II) COMPLEXES THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2009-12-31 US disclosed
WO-2009155509-A1 CLAY ACTIVATION OF PD(II) AND NI(II) COMPLEXES THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2009-12-23 WO disclosed