SCHEMBL807705

SCHEMBL807705

O=C(Nc1nccc2nc(-c3c(Cl)cccc3Cl)sc12)OF

nearest known ligand 0.81

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
TYK2 P29597 19/20 0.81
JAK2 O60674 8/20 0.69
USP2 O75604 1/20 0.35

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
SCHEMBL793104 0.90 TYK2 (1.00) TYK2JAK2
SCHEMBL792586 0.87 TYK2 (0.86) TYK2JAK2
SCHEMBL793004 0.86 TYK2 (0.77) TYK2JAK2
SCHEMBL793802 0.86 TYK2 (0.80) TYK2JAK2
SCHEMBL792134 0.86 TYK2 (0.80) TYK2JAK2
SCHEMBL792938 0.85 TYK2 (0.79) TYK2JAK2
SCHEMBL792704 0.84 TYK2 (0.70) TYK2JAK2
SCHEMBL793404 0.84 TYK2 (0.70) TYK2JAK2
SCHEMBL11899895 0.83 TYK2 (0.73) TYK2JAK2
SCHEMBL792573 0.83 TYK2 (1.00) TYK2JAK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2012035039-A1 AZABENZOTHIAZOLE COMPOUNDS, COMPOSITIONS AND METHODS OF USE F. HOFFMANN-LA ROCHE AG (CH) 2012-03-22 WO disclosed