SCHEMBL659213

SCHEMBL659213

O=S(=O)(Oc1cc2ccsc2cn1)C(F)(F)F

nearest known ligand 0.41

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CA2 P00918 11/20 0.41
CA1 P00915 2/20 0.41
PDE4A P27815 3/20 0.38
PDE4C Q08493 3/20 0.38
PDE4D Q08499 3/20 0.38
CA12 O43570 9/20 0.36
PTPRC P08575 1/20 0.35
PTPN6 P29350 1/20 0.35
PTPN11 Q06124 1/20 0.35
PTPN22 Q9Y2R2 1/20 0.35
PIK3CD O00329 1/20 0.33
ENPP1 P22413 1/20 0.32
ESR2 Q92731 1/20 0.31

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
SCHEMBL127875 0.76 PDE4A (0.46) CA2CA1PDE4APDE4CPDE4D
SCHEMBL2750162 0.74 PDE4A (0.38) CA2CA1PDE4APDE4CPDE4D
SCHEMBL2749607 0.74 THRB (0.40) CA2CA1PDE4APDE4CPDE4D
SCHEMBL31211442 0.74 PDE4A (0.38) CA2CA1PDE4APDE4CPDE4D
SCHEMBL31215470 0.74 CA2 (0.46) CA2CA1CA12ESR2
SCHEMBL661456 0.73 CA1 (0.35) CA2CA1PDE4APDE4CPDE4D
SCHEMBL18769994 0.73 PDE4A (0.38) CA2CA1PDE4APDE4CPDE4D
SCHEMBL29002668 0.73 CA2 (0.51) CA2CA1CA12ENPP1
SCHEMBL2748493 0.72 MAPT (0.42) CA2CA1PDE4APDE4CPDE4D
SCHEMBL2748735 0.72 L3MBTL1 (0.39) CA2CA1PDE4APDE4CPDE4D

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8378104-B2 7-aminofuropyridine derivatives OSI Pharmaceuticals, LLC (US) 2013-02-19 US disclosed
EP-2534156-A1 7-AMINOFUROPYRIDINE DERIVATIVES OSI Pharmaceuticals, LLC (US) 2012-12-19 EP disclosed
US-20120046267-A1 7-AMINOFUROPYRIDINE DERIVATIVES OSI PHARMACEUTICALS, INC. 2012-02-23 US disclosed
WO-2011100502-A1 7-AMINOFUROPYRIDINE DERIVATIVES OSI Pharmaceuticals, LLC (US) 2011-08-18 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-20120046267-A1 7-AMINOFUROPYRIDINE DERIVATIVES MAP3K5, STK17A, MAPKAPK5 CA2 3716/4885CA1 3407/4885PDE4A 2320/4885

“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.