SCHEMBL1743833

SCHEMBL1743833

CC(C)(C)OC(=O)N[C@H](CN(C(=O)OC(C)(C)C)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 9)

geneUniProtsupporting neighboursconfidence
PDPK1 O15530 1/20 0.33
CDK2 P24941 2/20 0.33
AKT1 P31749 2/20 0.33
GSK3B P49841 3/20 0.31
DYRK1A Q13627 3/20 0.31
WNT1 P04628 1/20 0.31
HDAC1 Q13547 1/20 0.30
HDAC8 Q9BY41 1/20 0.30
HDAC6 Q9UBN7 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
SCHEMBL2550224 0.96 PDPK1 (0.33) PDPK1GSK3BDYRK1AWNT1
SCHEMBL1745653 0.95 CDK2 (0.33) PDPK1CDK2AKT1GSK3BDYRK1A
SCHEMBL12241701 0.93 DYRK1A (0.33) PDPK1GSK3BDYRK1AWNT1
SCHEMBL1744755 0.91 GSK3B (0.31) PDPK1GSK3BDYRK1AWNT1
SCHEMBL2546671 0.89 CDK2 (0.35) PDPK1CDK2AKT1GSK3BDYRK1A
SCHEMBL1743834 0.86 CDK2 (0.30) CDK2AKT1
SCHEMBL1742990 0.85 DYRK1A (0.33) PDPK1CDK2AKT1GSK3BDYRK1A
SCHEMBL2549338 0.84 PPARG (0.32)
SCHEMBL1744751 0.83 CDK2 (0.35) PDPK1CDK2AKT1GSK3BDYRK1A
SCHEMBL1743840 0.83 AKT1 (0.40) PDPK1CDK2AKT1GSK3BDYRK1A

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 2 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

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 PDPK1 41/4885CDK2 151/4885AKT1 74/4885

“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.