SCHEMBL5658899

SCHEMBL5658899

CNc1nc2sc(NCCCOC)nc2c2c1ncn2C

nearest known ligand 0.72

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
IKBKB O14920 20/20 0.72
CHUK O15111 11/20 0.67

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
SCHEMBL5655707 0.88 IKBKB (0.77) IKBKBCHUK
SCHEMBL14589167 0.87 IKBKB (0.76) IKBKBCHUK
SCHEMBL14589173 0.86 IKBKB (0.85) IKBKBCHUK
SCHEMBL14589168 0.85 IKBKB (0.72) IKBKBCHUK
SCHEMBL5939971 0.85 IKBKB (0.72) IKBKBCHUK
SCHEMBL14589177 0.84 IKBKB (1.00) IKBKBCHUK
SCHEMBL14589176 0.83 IKBKB (0.80) IKBKBCHUK
SCHEMBL5655410 0.83 IKBKB (0.78) IKBKBCHUK
SCHEMBL14589389 0.81 IKBKB (0.74) IKBKBCHUK
SCHEMBL14589422 0.80 IKBKB (0.62) IKBKBCHUK

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-7176214-B2 Imidazo-fused oxazolo[4,5-β]pyridine and imidazo-fused thiazolo[4,5-β]pyridine based tricyclic compounds and pharmaceutical compositions comprising same BRISTOL-MYERS SQUIBB COMPANY (US) 2007-02-13 US disclosed
US-7176214-B2 Imidazo-fused oxazolo[4,5-β]pyridine and imidazo-fused thiazolo[4,5-β]pyridine based tricyclic compounds and pharmaceutical compositions comprising same BRISTOL-MYERS SQUIBB COMPANY (US) 2007-02-13 US disclosed