SCHEMBL557121

SCHEMBL557121

CCOP(=O)(OCC)C(F)(F)c1ccc(C(C)=CC(=O)Oc2c(Cl)c(Cl)c(Cl)c(Cl)c2Cl)cc1

nearest known ligand 0.38

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
NR4A1 P22736 1/20 0.38
NR4A2 P43354 1/20 0.38
NR4A3 Q92570 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.32
MAPT P10636 1/20 0.32
ALDH1A1 P00352 1/20 0.31

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
SCHEMBL557120 1.00 NR4A1 (0.38) NR4A1NR4A2NR4A3SMN1; SMN2MAPT
SCHEMBL556294 0.83 TSHR (0.35) NR4A1NR4A2NR4A3MAPTALDH1A1
SCHEMBL556293 0.83 TSHR (0.35) NR4A1NR4A2NR4A3MAPTALDH1A1
SCHEMBL556251 0.82 NR4A1 (0.41) NR4A1NR4A2NR4A3SMN1; SMN2MAPT
SCHEMBL16069992 0.81 NR4A1 (0.58) NR4A1NR4A2NR4A3SMN1; SMN2ALDH1A1
SCHEMBL16069970 0.81 NR4A1 (0.58) NR4A1NR4A2NR4A3SMN1; SMN2ALDH1A1
SCHEMBL16069969 0.81 NR4A1 (0.58) NR4A1NR4A2NR4A3SMN1; SMN2ALDH1A1
SCHEMBL556415 0.80 CA1 (0.41) ALDH1A1
SCHEMBL556416 0.80 CA1 (0.41) ALDH1A1
SCHEMBL556709 0.79 TSHR (0.38) SMN1; SMN2MAPTALDH1A1

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 NR4A1 1016/4885NR4A2 764/4885NR4A3 342/4885

“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.