SCHEMBL2547847

SCHEMBL2547847

COCc1nc(N(C[C@@H](Cc2ccc(C(C)(F)F)nc2)NC(=O)OC(C)(C)C)C(=O)O)sc1-c1ccc2cnc(F)cc2c1

nearest known ligand 0.31

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 1/20 0.31
GSK3B P49841 1/20 0.30
DYRK1A Q13627 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
SCHEMBL2547843 1.00 PTPN1 (0.31) PTPN1GSK3BDYRK1A
SCHEMBL1743581 0.95 PTPN1 (0.31) PTPN1GSK3BDYRK1A
SCHEMBL2548917 0.85 PTPRB (0.34) PTPN1GSK3BDYRK1A
SCHEMBL2548919 0.85 PTPRB (0.34) PTPN1GSK3BDYRK1A
SCHEMBL2548035 0.84 ATM (0.33) PTPN1
SCHEMBL2548038 0.84 ATM (0.33) PTPN1
SCHEMBL1743842 0.81 AKT1 (0.36) PTPN1GSK3BDYRK1A
SCHEMBL2546473 0.80 GSK3B (0.31) GSK3BDYRK1A
SCHEMBL1744804 0.80 GSK3B (0.31) GSK3BDYRK1A
SCHEMBL2546476 0.80 GSK3B (0.31) GSK3BDYRK1A

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
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 PTPN1 590/4885GSK3B 145/4885DYRK1A 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.