SCHEMBL2997700

SCHEMBL2997700

O=P(O)(O)c1ccc(O)cc1.[NaH]

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA2 P00918 4/20 0.55
CA4 P22748 3/20 0.55
CA5A P35218 3/20 0.55
ESR1 P03372 5/20 0.50
CA12 O43570 3/20 0.44
CA1 P00915 3/20 0.44
LMNA P02545 3/20 0.44
MEN1 O00255 3/20 0.44
KMT2A Q03164 3/20 0.44
KDM4E B2RXH2 2/20 0.44
MAPT P10636 2/20 0.44
HPGD P15428 2/20 0.44
CA3 P07451 2/20 0.44
TYR P14679 2/20 0.44
CA9 Q16790 2/20 0.44
CA14 Q9ULX7 2/20 0.44
CA5B Q9Y2D0 2/20 0.44
CYP3A4 P08684 2/20 0.44
BLM P54132 2/20 0.44
PMP22 Q01453 2/20 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
SCHEMBL915277 0.97 CA2 (0.57) CA2CA4CA5AESR1CA12
SCHEMBL28886060 0.90 ESR1 (0.55) CA2CA4CA5AESR1CA12
SCHEMBL2997406 0.87 MEN1 (0.58) CA2CA4CA5AESR1MEN1
SCHEMBL2171752 0.85 CA2 (0.71) CA2CA4CA5AESR1LMNA
SCHEMBL916043 0.80 LMNA (0.59) CA2CA4CA5AESR1CA12
Phenylphosphonic Acid SCHEMBL28738236 0.79 CA2 (0.80) CA2CA4CA5AESR1CA12
Phenylphosphonic Acid SCHEMBL29646132 0.79 CA2 (0.70) CA2CA4CA5AESR1LMNA
Hydroquinone SCHEMBL329315 0.78 CA12 (0.61) CA2CA4CA5AESR1CA12
Hydroquinone SCHEMBL131228 0.78 CA12 (0.61) CA2CA4CA5AESR1CA12
SCHEMBL22999982 0.77 CA2 (0.60) CA2CA4CA5AESR1LMNA

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
US-20100197815-A1 Polyparaphenylene Hydrocarbon Electrolyte, Manufacture Method Therefor, and Polyparaphenylene as well as Electrolyte Membrane, Catalyst Layer and Solid Polymer Fuel Cell TOYOTA JIDOSHA KABUSHIKI KAISHA (JP) 2010-08-05 US disclosed
EP-1999179-A2 POLYPARAPHENYLENE HYDROCARBON ELECTROLYTE, MANUFACTURE METHOD THEREFOR, AND POLYPARAPHENYLENE AS WELL AS ELECTROLYTE MEMBRANE, CATALYST LAYER AND SOLID POLYMER FUEL CELL TOYOTA JIDOSHA KABUSHIKI KAISHA (JP) 2008-12-10 EP disclosed
WO-2007110766-A2 POLYPARAPHENYLENE HYDROCARBON ELECTROLYTE, MANUFACTURE METHOD THEREFOR, AND POLYPARAPHENYLENE AS WELL AS ELECTROLYTE MEMBRANE, CATALYST LAYER AND SOLID POLYMER FUEL CELL TOYOTA JIDOSHA KABUSHIKI KAISHA (DE) 2007-10-04 WO disclosed