SCHEMBL20155413

SCHEMBL20155413

Cn1cc(-c2cc(N)cnc2Oc2ccc(F)cc2F)c2c(ccn2COCC[Si](C)(C)C)c1=O

nearest known ligand 0.45

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 20/20 0.45

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
SCHEMBL20154915 0.90 BRD4 (0.44) BRD4
SCHEMBL20154961 0.86 BRD4 (0.60) BRD4
SCHEMBL20155402 0.86 BRD4 (0.52) BRD4
SCHEMBL20155080 0.84 BRD4 (0.45) BRD4
SCHEMBL20155509 0.82 BRD4 (0.35) BRD4
SCHEMBL20155012 0.79 BRD4 (0.61) BRD4
SCHEMBL20155423 0.78 BRD4 (0.49) BRD4
SCHEMBL16738863 0.78 BRD4 (0.43) BRD4
SCHEMBL19931209 0.76 BRD4 (0.53) BRD4
SCHEMBL20155086 0.76 BRD4 (0.44) BRD4

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