SCHEMBL17103796

SCHEMBL17103796

CC(C)CNc1nc(C#CCCC(C)C(=O)O)cn2c(-c3ccc(C(=O)NC4CC4)cc3)cnc12

nearest known ligand 0.83

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ TTK P33981 20/20 0.83

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
SCHEMBL14834319 0.91 TTK (1.00) TTK
SCHEMBL14834321 0.90 TTK (0.94) TTK
SCHEMBL14834723 0.89 TTK (1.00) TTK
SCHEMBL14834797 0.89 TTK (1.00) TTK
SCHEMBL14834928 0.89 TTK (1.00) TTK
SCHEMBL14834719 0.89 TTK (1.00) TTK
SCHEMBL14834733 0.88 TTK (1.00) TTK
SCHEMBL14834502 0.88 TTK (1.00) TTK
SCHEMBL9937747 0.88 TTK (1.00) TTK
SCHEMBL14834891 0.88 TTK (1.00) 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-2576560-B1 SUBSTITUTED IMIDAZOPYRAZINES BAYER IP GMBH (DE) 2015-09-30 — — EP claimed
Send feedback