SCHEMBL1921730

SCHEMBL1921730

O=P(O)(F)OC(F)(CC(F)(F)F)c1ccccc1

nearest known ligand 0.48

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 6/20 0.48
PGK1 P00558 4/20 0.42
PGK2 P07205 4/20 0.42
PTPN5 P54829 2/20 0.40
ACP3 P15309 4/20 0.36
PTPRC P08575 1/20 0.36
PTPN2 P17706 1/20 0.36
PTPRB P23467 1/20 0.36
PTPN6 P29350 1/20 0.36
PTPN11 Q06124 1/20 0.36
TSHR P16473 2/20 0.34
ALDH1A1 P00352 1/20 0.34

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
SCHEMBL1922323 0.79 KCNN4 (0.34) PTPN1PGK1PGK2PTPN5ACP3
SCHEMBL1276839 0.75 PTPN1 (0.52) PTPN1PGK1PGK2PTPN5ACP3
SCHEMBL1150576 0.74 PTPN1 (0.50) PTPN1PGK1PGK2PTPN5ACP3
SCHEMBL1922027 0.73 CES2 (0.32) PGK1PGK2
SCHEMBL1276687 0.72 PTPN1 (0.48) PTPN1PGK1PGK2PTPN5ACP3
SCHEMBL781227 0.70 PTPN1 (0.55) PTPN1PGK1PGK2PTPN5PTPN2
SCHEMBL780933 0.70 PTPN1 (0.55) PTPN1PGK1PGK2PTPN5PTPN2
SCHEMBL1276706 0.68 FDPS (0.47) PTPN1PGK1PGK2PTPRCTSHR
SCHEMBL6428108 0.66 PTPN1 (1.00) PTPN1PGK1PGK2PTPN5PTPN2
SCHEMBL1923301 0.66 PGK1 (0.31) PGK1PGK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2330675-B1 SECONDARY BATTERY NEC CORP (JP) 2018-08-22 EP disclosed
EP-2330675-A1 SECONDARY BATTERY NEC Corporation (JP) 2011-06-08 EP disclosed