SCHEMBL20155732

SCHEMBL20155732

CC(C)On1cc2c(=O)[nH]cc(Br)c2n1

nearest known ligand 0.30

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
GSK3B P49841 1/20 0.30

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
SCHEMBL20155724 0.83 GSK3B (0.32) GSK3B
SCHEMBL20155157 0.79 GSK3B (0.30) GSK3B
SCHEMBL20155622 0.72 JAK2 (0.34)
SCHEMBL20155615 0.71 GSK3B (0.34) GSK3B
SCHEMBL7463262 0.58 GSK3B (0.32) GSK3B
SCHEMBL30231227 0.58 AXL (0.53) GSK3B
SCHEMBL30231120 0.58 AXL (0.53) GSK3B
SCHEMBL16652137 0.58 GSK3B (0.37) GSK3B
SCHEMBL16475105 0.57 MAPK1 (0.57) GSK3B
SCHEMBL31135946 0.57 MAPK1 (0.57) GSK3B

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-2018086604-A1 NITROGEN-CONTAINING HETEROCYCLIC COMPOUNDS, PREPARATION METHOD THEREFOR, PHARMACEUTICAL COMPOSITION THEREOF, AND APPLICATIONS THEREOF 山东罗欣药业集团股份有限公司 2018-05-17 WO disclosed