SCHEMBL14589117

SCHEMBL14589117

Cc1nc2c(nc(C)c3ncn(C)c32)s1

nearest known ligand 0.49

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ IKBKB O14920 20/20 0.49
▸ CHUK O15111 12/20 0.49

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
SCHEMBL14589121 0.84 IKBKB (0.47) IKBKBCHUK
SCHEMBL14014418 0.84 IKBKB (0.47) IKBKBCHUK
SCHEMBL14589119 0.81 IKBKB (0.69) IKBKBCHUK
SCHEMBL14589118 0.79 IKBKB (0.70) IKBKBCHUK
SCHEMBL27285050 0.70 ADORA2A (0.35) IKBKBCHUK
SCHEMBL5657426 0.68 IKBKB (0.47) IKBKBCHUK
SCHEMBL12020962 0.67 IKBKB (0.46) IKBKBCHUK
SCHEMBL5658311 0.67 IKBKB (0.46) IKBKBCHUK
SCHEMBL14589120 0.67 IKBKB (0.49) IKBKBCHUK
SCHEMBL12021015 0.65 IKBKB (0.67) 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
Send feedback