SCHEMBL17425397

SCHEMBL17425397

Cc1cc(-c2cnc3c(NCCC(F)(F)F)cc([S+]([O-])c4ccccc4)nn23)ccc1C(=O)NC1CC1

nearest known ligand 0.67

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
TTK P33981 20/20 0.67

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
SCHEMBL458429 0.94 TTK (0.74) TTK
SCHEMBL19336836 0.86 TTK (0.73) TTK
SCHEMBL18043852 0.86 TTK (0.75) TTK
SCHEMBL457096 0.85 TTK (0.68) TTK
SCHEMBL456455 0.85 TTK (0.71) TTK
SCHEMBL456015 0.85 TTK (0.71) TTK
SCHEMBL455939 0.85 TTK (0.68) TTK
SCHEMBL17416388 0.85 TTK (0.77) TTK
SCHEMBL469886 0.84 TTK (0.73) TTK
SCHEMBL457292 0.84 TTK (0.70) 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
EP-2614063-B1 SUBSTITUTED IMIDAZOPYRIDAZINES BAYER IP GMBH (DE) 2016-01-13 EP disclosed