SCHEMBL557182

SCHEMBL557182

CCOP(=O)(OCC)Oc1ccc(/C(C)=C/C(=O)OC(C)(C)C)cc1

nearest known ligand 0.44

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CA2 P00918 2/20 0.44
CA1 P00915 1/20 0.44
BCHE P06276 1/20 0.44
ACHE P22303 1/20 0.44
STAT6 P42226 3/20 0.37
MEN1 O00255 1/20 0.36
POLB P06746 1/20 0.36
GAA P10253 1/20 0.36
KMT2A Q03164 1/20 0.36
BLM P54132 1/20 0.35
ELANE P08246 1/20 0.35
LTB4R Q15722 3/20 0.34
LTB4R2 Q9NPC1 3/20 0.34
PLK1 P53350 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
SCHEMBL557184 1.00 CA2 (0.44) CA2CA1BCHEACHESTAT6
SCHEMBL557324 0.82 CA1 (0.49) CA2CA1BCHEACHESTAT6
SCHEMBL557322 0.82 CA1 (0.49) CA2CA1BCHEACHESTAT6
SCHEMBL557323 0.82 CA1 (0.49) CA2CA1BCHEACHESTAT6
SCHEMBL556415 0.79 CA1 (0.41) CA2CA1BCHEACHESTAT6
SCHEMBL556251 0.79 NR4A1 (0.41) MEN1KMT2ALTB4RLTB4R2
SCHEMBL556416 0.79 CA1 (0.41) CA2CA1BCHEACHESTAT6
SCHEMBL556916 0.76 CA1 (0.57) CA2CA1BCHEACHEMEN1
SCHEMBL7302415 0.74 MAPT (0.47) CA2CA1POLBKMT2AELANE
SCHEMBL5026807 0.73 CA2 (0.70) CA2CA1BCHEACHEMEN1

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
US-20120035114-A1 INHIBITORS OF STAT3 AND USES THEREOF BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 2012-02-09 US 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-20120035114-A1 INHIBITORS OF STAT3 AND USES THEREOF STAT3, JAK2, STAT6 CA2 4451/4885CA1 4749/4885BCHE 4848/4885

“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.