SCHEMBL31460269

SCHEMBL31460269

O=P(O)(O)F.[Li]c1ccccc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA2 P00918 1/20 0.46
CA4 P22748 1/20 0.46
CA5A P35218 1/20 0.46
PTPN1 P18031 1/20 0.44
CA12 O43570 1/20 0.41
CA9 Q16790 1/20 0.41
SRC P12931 2/20 0.41
CFTR P13569 1/20 0.41
PTPN5 P54829 1/20 0.39
TSHR P16473 2/20 0.38
ALOX15 P16050 1/20 0.38
PGK1 P00558 3/20 0.37
PGK2 P07205 3/20 0.37
MEN1 O00255 1/20 0.37
ALDH1A1 P00352 1/20 0.37
KMT2A Q03164 1/20 0.37
CYP2C9 P11712 1/20 0.37
CYP2C19 P33261 1/20 0.37
MMP8 P22894 1/20 0.36
MMP14 P50281 1/20 0.36

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
Phosphoric Acid SCHEMBL29043954 0.89 CA2 (0.50) CA2CA4CA5APTPN1CA12
SCHEMBL28069 0.76
Biphenyl SCHEMBL27796608 0.76 PTPN5 (0.56) CA2CA4CA5APTPN1CA9
SCHEMBL28421227 0.74
SCHEMBL31460343 0.73 TSHR (0.47) CA2CA4CA5APTPN1CA12
SCHEMBL1820268 0.73
Methane SCHEMBL28886214 0.73
SCHEMBL3808897 0.73
SCHEMBL9161603 0.73
Fluoride SCHEMBL29013919 0.73

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
WO-2025095088-A1 NON-AQUEOUS ELECTROLYTE SOLUTION FOR SECONDARY BATTERY, AND SECONDARY BATTERY PROVIDED WITH SAID SOLUTION ステラケミファ株式会社 2025-05-08 WO disclosed