SCHEMBL456486

SCHEMBL456486

Cc1cc(-c2c(NC3CCCC3)nn3ccnc3c2NCCC(F)(F)F)ccc1C(=O)NC1CC1

nearest known ligand 0.59

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
TTK P33981 20/20 0.59

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
SCHEMBL12985830 0.80 TTK (0.59) TTK
SCHEMBL15555406 0.75 TTK (0.46) TTK
SCHEMBL470188 0.75 TTK (0.74) TTK
SCHEMBL456487 0.75 TTK (0.52) TTK
SCHEMBL457294 0.75 TTK (0.47) TTK
SCHEMBL9966528 0.74 TTK (1.00) TTK
SCHEMBL458323 0.73 TTK (0.53) TTK
SCHEMBL12986202 0.73 TTK (0.52) TTK
SCHEMBL459012 0.72 TTK (0.46) TTK
SCHEMBL457865 0.72 TTK (0.52) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2614063-A1 SUBSTITUTED IMIDAZOPYRIDAZINES Bayer Intellectual Property GmbH (DE) 2013-07-17 EP disclosed
WO-2012032031-A1 SUBSTITUTED IMIDAZOPYRIDAZINES BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2012-03-15 WO disclosed