SCHEMBL5657512

SCHEMBL5657512

CNc1nc2sc(NC3CCCCC3)nc2c2c1ncn2C

nearest known ligand 0.70

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
IKBKB O14920 19/20 0.70
CHUK O15111 10/20 0.70

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
SCHEMBL5658962 0.99 IKBKB (0.71) IKBKBCHUK
SCHEMBL5659764 0.83 IKBKB (0.64) IKBKBCHUK
SCHEMBL5659079 0.81 IKBKB (0.65) IKBKBCHUK
SCHEMBL14589377 0.80 IKBKB (0.98) IKBKBCHUK
SCHEMBL14589416 0.80 IKBKB (0.60) IKBKBCHUK
SCHEMBL5657200 0.79 IKBKB (0.82) IKBKBCHUK
SCHEMBL5658520 0.79 IKBKB (0.65) IKBKBCHUK
SCHEMBL5657062 0.79 IKBKB (0.68) IKBKBCHUK
SCHEMBL14589394 0.78 IKBKB (1.00) IKBKBCHUK
SCHEMBL14589417 0.78 IKBKB (0.60) 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