SCHEMBL1743901

SCHEMBL1743901

CC(C)(C)OC(=O)N[C@@H](Cc1cnc(F)c(Cl)c1)CN(C(=O)OC(C)(C)C)c1ncc(-c2ccc3cnc(F)cc3c2)s1

nearest known ligand 0.33

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
GSK3B P49841 3/20 0.33
DYRK1A Q13627 3/20 0.33
PDPK1 O15530 1/20 0.33
WNT1 P04628 1/20 0.32
PTPRB P23467 1/20 0.32
PTPN1 P18031 1/20 0.31
AAK1 Q2M2I8 1/20 0.30
ATM Q13315 1/20 0.30
SYK P43405 1/20 0.30

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
SCHEMBL3780135 0.94 DYRK1A (0.33) GSK3BDYRK1APDPK1WNT1PTPRB
SCHEMBL3780133 0.94 DYRK1A (0.33) GSK3BDYRK1APDPK1WNT1PTPRB
SCHEMBL12266678 0.87 DYRK1A (0.33) GSK3BDYRK1APDPK1WNT1PTPRB
SCHEMBL1743840 0.87 AKT1 (0.40) GSK3BDYRK1APDPK1WNT1PTPRB
SCHEMBL1744901 0.87 PTPRB (0.35) GSK3BDYRK1APDPK1WNT1PTPRB
SCHEMBL2549583 0.86 MLYCD (0.37) GSK3BDYRK1APDPK1WNT1PTPRB
SCHEMBL12241747 0.86 DYRK1A (0.34) GSK3BDYRK1APDPK1WNT1PTPRB
SCHEMBL13286102 0.86 DYRK1A (0.34) GSK3BDYRK1APDPK1WNT1PTPRB
SCHEMBL1743902 0.84 GSK3B (0.30) GSK3BDYRK1A
SCHEMBL12241738 0.83 AAK1 (0.36) AAK1ATMSYK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2387570-A1 FLUOROISOQUINOLINE SUBSTITUTED THIAZOLE COMPOUNDS AND METHODS OF USE Amgen, Inc (US) 2011-11-23 EP disclosed
US-20110263647-A1 FLUOROISOQUINOLINE SUBSTITUTED THIAZOLE COMPOUNDS AND METHODS OF USE AMGEN INC. (US) 2011-10-27 US disclosed
US-20110263647-A1 FLUOROISOQUINOLINE SUBSTITUTED THIAZOLE COMPOUNDS AND METHODS OF USE AMGEN INC. (US) 2011-10-27 US disclosed
US-20110263647-A1 FLUOROISOQUINOLINE SUBSTITUTED THIAZOLE COMPOUNDS AND METHODS OF USE AMGEN INC. (US) 2011-10-27 US disclosed
WO-2010083246-A1 FLUOROISOQUINOLINE SUBSTITUTED THIAZOLE COMPOUNDS AND METHODS OF USE AMGEN INC. (US) 2010-07-22 WO disclosed
WO-2010083246-A1 FLUOROISOQUINOLINE SUBSTITUTED THIAZOLE COMPOUNDS AND METHODS OF USE AMGEN INC. (US) 2010-07-22 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-20110263647-A1 FLUOROISOQUINOLINE SUBSTITUTED THIAZOLE COMPOUNDS AND METHODS OF USE TFEB, PCK2, JAK2 GSK3B 145/4885DYRK1A 2916/4885PDPK1 41/4885

“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.