SCHEMBL556916

SCHEMBL556916

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

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 1/20 0.57
CA2 P00918 1/20 0.57
BCHE P06276 1/20 0.57
ACHE P22303 1/20 0.57
MAPT P10636 3/20 0.52
HPGD P15428 1/20 0.52
RAB9A P51151 1/20 0.52
L3MBTL1 Q9Y468 1/20 0.50
GAA P10253 2/20 0.49
POLB P06746 2/20 0.46
KMT2A Q03164 2/20 0.46
MEN1 O00255 1/20 0.46
BLM P54132 1/20 0.46
LMNA P02545 1/20 0.46
NPSR1 Q6W5P4 1/20 0.46
MAOB P27338 3/20 0.44
STS P08842 1/20 0.43
ALDH1A1 P00352 1/20 0.42
CYP3A4 P08684 1/20 0.42
TSHR P16473 1/20 0.42

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
SCHEMBL5026807 0.87 CA2 (0.70) CA1CA2BCHEACHEGAA
SCHEMBL22322000 0.82 CA2 (0.57) CA1CA2BCHEACHEGAA
SCHEMBL7018792 0.81 CA2 (0.60) CA1CA2BCHEACHEGAA
SCHEMBL557322 0.81 CA1 (0.49) CA1CA2BCHEACHEGAA
SCHEMBL557323 0.81 CA1 (0.49) CA1CA2BCHEACHEGAA
SCHEMBL557324 0.81 CA1 (0.49) CA1CA2BCHEACHEGAA
SCHEMBL10889182 0.81 MAPT (0.43) CA1CA2BCHEACHEMAPT
SCHEMBL22322001 0.81 CA2 (0.55) CA1CA2BCHEACHEGAA
SCHEMBL10442737 0.80 MAPT (0.53) MAPTHPGDRAB9AL3MBTL1GAA
SCHEMBL8490220 0.80 MAPT (0.53) MAPTHPGDRAB9AL3MBTL1KMT2A

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-8841257-B2 Inhibitors of STAT3 and uses thereof BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 2014-09-23 US disclosed
US-20120035114-A1 INHIBITORS OF STAT3 AND USES THEREOF BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 2012-02-09 US disclosed
WO-2010118309-A2 INHIBITORS OF STAT3 AND USES THEREOF BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 2010-10-14 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-20120035114-A1 INHIBITORS OF STAT3 AND USES THEREOF STAT3, JAK2, STAT6 CA1 4749/4885CA2 4451/4885BCHE 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.