SCHEMBL6153662

SCHEMBL6153662

O=P(OO)(OO)C(F)(F)c1ccc(Oc2c[c]ccc2)cc1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 3/20 0.37
PGK1 P00558 1/20 0.34
PGK2 P07205 1/20 0.34
PTPN1 P18031 3/20 0.34
PTPN2 P17706 2/20 0.34
PTPRB P23467 2/20 0.34
PTPN6 P29350 2/20 0.34
PTPN11 Q06124 2/20 0.34
PTPRC P08575 1/20 0.34
CDC25A P30304 1/20 0.34
PGR P06401 1/20 0.33
PARP10 Q53GL7 1/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
LTA4H P09960 1/20 0.33
EPHX2 P34913 1/20 0.33
PTPN5 P54829 3/20 0.33
PDK2 Q15119 2/20 0.32
MMP2 P08253 2/20 0.32
CA9 Q16790 2/20 0.32

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
SCHEMBL6153667 0.86 PGK1 (0.51) PGK1PGK2PTPN1PTPN2PTPRB
SCHEMBL921675 0.78 MAPK14 (0.41) MAPK14PGRMEN1KMT2ALTA4H
SCHEMBL28072263 0.74 LTA4H (0.55) PARP10MEN1KMT2ALTA4HCA9
SCHEMBL61732 0.72 LTA4H (0.57) PARP10MEN1KMT2ALTA4HCA9
SCHEMBL512275 0.71 MAPT (0.52) MEN1KMT2ALTA4HCA9CA1
SCHEMBL921822 0.71 EPHX2 (0.39) MAPK14MEN1KMT2ALTA4HEPHX2
SCHEMBL8155454 0.70 LTA4H (0.43) MEN1KMT2ALTA4HCA1CA2
SCHEMBL6154322 0.69 LTA4H (0.59) PARP10MEN1KMT2ALTA4HCA1
SCHEMBL157734 0.69 SOS1 (0.40) MEN1KMT2ALTA4HEPHX2
SCHEMBL2097644 0.69 LTA4H (0.31) LTA4HPDK2PDK1PDK3PDK4

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-20050065118-A1 Organosulfur inhibitors of tyrosine phosphatases METABASIS THERAPEUTICS, INC. 2005-03-24 US disclosed
EP-1446110-A2 ORGANOSULFUR INHIBITORS OF TYROSINE PHOSPHATASES Structural Bioinformatics Inc. (US) 2004-08-18 EP disclosed
WO-2003032916-A2 ORGANOSULFUR INHIBITORS OF TYROSINE PHOSPHATASES STRUCTURAL BIOINFORMATICS INC. (US) 2003-04-24 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20050065118-A1 Organosulfur inhibitors of tyrosine phosphatases PTPRS, PTPRJ, PTPRCAP MAPK14 1731/4885PGK1 1860/4885PGK2 1206/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.