SCHEMBL13077239

SCHEMBL13077239

O=C(NC1CC1)c1ccc(-c2cnc3c(NC[C@@H](O)CO)nc4ccc(F)cc4n23)cc1

nearest known ligand 0.53

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
TTK P33981 20/20 0.53

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
SCHEMBL176028 1.00 TTK (0.53) TTK
SCHEMBL120608 0.91 TTK (0.54) TTK
SCHEMBL13077246 0.91 TTK (0.54) TTK
SCHEMBL3724631 0.90 TTK (0.66) TTK
SCHEMBL6113459 0.89 TTK (0.58) TTK
SCHEMBL119817 0.89 TTK (0.51) TTK
SCHEMBL8279938 0.89 TTK (0.51) TTK
SCHEMBL8280137 0.88 TTK (0.58) TTK
SCHEMBL3722989 0.88 TTK (0.58) TTK
SCHEMBL176219 0.88 TTK (0.57) 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