SCHEMBL1344778

SCHEMBL1344778

CCOC(=O)c1cn2c3c(c(F)c(F)c(N)c3c1=O)OC[C@@H]2CF

nearest known ligand 0.45

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
STAT3 P40763 1/20 0.43
GSK3B P49841 12/20 0.42
HTT P42858 1/20 0.39
CNR1 P21554 1/20 0.39
CNR2 P34972 1/20 0.39
TOP2A P11388 2/20 0.37
TOP2B Q02880 2/20 0.37
TSHR P16473 1/20 0.37
CASP1 P29466 1/20 0.37
ADRB2 P07550 1/20 0.36

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
SCHEMBL12130963 1.00 STAT3 (0.43) STAT3GSK3BHTTCNR1CNR2
SCHEMBL12130952 0.87 GSK3B (0.49) STAT3GSK3BCNR1CNR2
SCHEMBL1345172 0.87 GSK3B (0.49) STAT3GSK3BCNR1CNR2
SCHEMBL1342922 0.87 GSK3B (0.51) GSK3BTOP2ATOP2B
SCHEMBL2559321 0.87 GSK3B (0.51) GSK3BTOP2ATOP2B
SCHEMBL12130965 0.85 STAT3 (0.41) STAT3GSK3BHTTCNR1CNR2
SCHEMBL1345564 0.85 STAT3 (0.41) STAT3GSK3BHTTCNR1CNR2
SCHEMBL12131489 0.83 GSK3B (0.37) GSK3BCNR1CNR2
SCHEMBL12130966 0.81 CNR1 (0.58) STAT3HTTCNR1CNR2TOP2A
SCHEMBL1344388 0.81 CNR1 (0.58) STAT3HTTCNR1CNR2TOP2A

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 8 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
US-8063221-B2 Aminoquinolones as GSK-3 inhibitors KYORIN PHARMACEUTICAL CO., LTD. (JP) 2011-11-22 US disclosed
US-8063221-B2 Aminoquinolones as GSK-3 inhibitors KYORIN PHARMACEUTICAL CO., LTD. (JP) 2011-11-22 US 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
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
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 115/4885GSK3B 1/4885HTT 3259/4885

“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.