SCHEMBL1344895

SCHEMBL1344895

CC[C@H]1Oc2c(F)c(F)c(F)c3c(=O)c(C(=O)O)cn(c23)C1c1ccccc1

nearest known ligand 0.40

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
STAT3 P40763 1/20 0.40
TOP2A P11388 2/20 0.40
TOP2B Q02880 2/20 0.40
GSK3B P49841 14/20 0.40
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
ALDH1A1 P00352 1/20 0.38
HTT P42858 1/20 0.38
CHRM1 P11229 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
SCHEMBL1342568 1.00 STAT3 (0.40) STAT3TOP2ATOP2BGSK3BMEN1
SCHEMBL1345049 0.85 GSK3B (0.42) STAT3TOP2ATOP2BGSK3BMEN1
SCHEMBL1343287 0.83 GSK3B (0.59) GSK3B
SCHEMBL1343226 0.83 GSK3B (0.59) GSK3B
SCHEMBL5482130 0.74 TOP2A (0.49) STAT3TOP2ATOP2BGSK3BMEN1
SCHEMBL5473835 0.74 TOP2A (0.49) STAT3TOP2ATOP2BGSK3BMEN1
SCHEMBL3812517 0.73 TOP2A (0.47) STAT3TOP2ATOP2BGSK3BMEN1
SCHEMBL1345565 0.71 PIM1 (0.35) STAT3TOP2ATOP2BGSK3BMEN1
SCHEMBL1345771 0.70 GSK3B (0.49) STAT3TOP2ATOP2BGSK3BMEN1
SCHEMBL1344894 0.69 STAT3 (0.49) STAT3TOP2ATOP2BGSK3BHTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2013182-B1 AMINOQUINOLONES AS GSK-3 INHIBITORS KYORIN SEIYAKU KK (JP) 2013-09-04 EP disclosed
EP-2383271-B1 Aminoquinolones as GSK-3 Inhibitors KYORIN SEIYAKU KK (JP) 2013-07-10 EP disclosed
US-8063221-B2 Aminoquinolones as GSK-3 inhibitors KYORIN PHARMACEUTICAL CO., LTD. (JP) 2011-11-22 US disclosed
EP-2383271-A1 Aminoquinolones as GSK-3 Inhibitors Kyorin Pharmaceutical Co., Ltd. (JP) 2011-11-02 EP disclosed
US-20070254866-A1 Aminoquinolones as GSK-3 inhibitors KYORIN PHARMACEUTICAL CO., LTD. (JP) 2007-11-01 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-20070254866-A1 Aminoquinolones as GSK-3 inhibitors GSK3B, GSK3A, GSKIP STAT3 115/4885TOP2A 205/4885TOP2B 512/4885

“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.