SCHEMBL14589119

SCHEMBL14589119

CSc1nc2c(nc(C)c3ncn(C)c32)s1

nearest known ligand 0.69

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ IKBKB O14920 19/20 0.69
▸ CHUK O15111 11/20 0.69
▸ GRM1 Q13255 1/20 0.34

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
SCHEMBL12021015 0.84 IKBKB (0.67) IKBKBCHUKGRM1
SCHEMBL5655531 0.82 IKBKB (1.00) IKBKBCHUK
SCHEMBL14589117 0.81 IKBKB (0.49) IKBKBCHUK
SCHEMBL14589121 0.79 IKBKB (0.47) IKBKBCHUK
SCHEMBL14589118 0.74 IKBKB (0.70) IKBKBCHUK
SCHEMBL5660641 0.72 IKBKB (0.65) IKBKBCHUK
SCHEMBL5659200 0.70 IKBKB (0.50) IKBKBCHUKGRM1
SCHEMBL5939971 0.70 IKBKB (0.72) IKBKBCHUK
SCHEMBL5657595 0.68 IKBKB (0.75) IKBKBCHUK
SCHEMBL14014381 0.68 IKBKB (0.48) 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 1 patent. 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
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