SCHEMBL13077299

SCHEMBL13077299

CNC(=O)Nc1ccc(-c2cnc3c(NCCC(C)C)nc4cc(N)ccc4n23)cc1

nearest known ligand 0.47

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ TTK P33981 3/20 0.47
▸ BRD4 O60885 15/20 0.44
▸ IKBKB O14920 1/20 0.34
▸ CHUK O15111 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
SCHEMBL13077306 0.91 IKBKB (0.43) TTKBRD4IKBKBCHUK
SCHEMBL13077300 0.89 BRD4 (0.43) TTKBRD4IKBKBCHUK
SCHEMBL3804195 0.88 TTK (0.46) TTKBRD4
SCHEMBL13077304 0.86 TTK (0.47) TTKBRD4IKBKBCHUK
SCHEMBL13077296 0.84 TTK (0.41) TTKBRD4
SCHEMBL13077309 0.82 RAB9A (0.41) TTKBRD4
SCHEMBL13077297 0.82 TTK (0.41) TTKBRD4
SCHEMBL13077301 0.82 FYN (0.42) TTKBRD4
SCHEMBL13077292 0.82 RAB9A (0.42) TTKBRD4
SCHEMBL13077291 0.82 TTK (0.41) TTK

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-2010124826-A1 SUBSTITUTED IMIDAZOQUINOXALINES BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2010-11-04 — — WO disclosed
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