SCHEMBL1745653

SCHEMBL1745653

CC(C)(C)OC(=O)N[C@H](CN(C(=O)O)c1ncc(-c2ccc3cnc(F)cc3c2)s1)[C@@H](O[Si](C)(C)C(C)(C)C)c1ccc(C(F)(F)F)cc1

nearest known ligand 0.33

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CDK2 P24941 3/20 0.33
AKT1 P31749 3/20 0.33
DYRK1A Q13627 4/20 0.31
GSK3B P49841 3/20 0.31
WNT1 P04628 1/20 0.31
PDPK1 O15530 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
SCHEMBL1744755 0.96 GSK3B (0.31) DYRK1AGSK3BWNT1PDPK1
SCHEMBL1743833 0.95 PDPK1 (0.33) CDK2AKT1DYRK1AGSK3BWNT1
SCHEMBL1743834 0.91 CDK2 (0.30) CDK2AKT1
SCHEMBL2550224 0.91 PDPK1 (0.33) DYRK1AGSK3BWNT1PDPK1
SCHEMBL1744751 0.89 CDK2 (0.35) CDK2AKT1DYRK1AGSK3BWNT1
SCHEMBL12241701 0.88 DYRK1A (0.33) DYRK1AGSK3BWNT1PDPK1
SCHEMBL2550226 0.87
SCHEMBL1744914 0.85 DYRK1A (0.33) CDK2AKT1DYRK1AGSK3BWNT1
SCHEMBL2550279 0.84 PPARG (0.34)
SCHEMBL2546671 0.83 CDK2 (0.35) CDK2AKT1DYRK1AGSK3BWNT1

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
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
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 CDK2 151/4885AKT1 74/4885DYRK1A 2916/4885

“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.