SCHEMBL20155733

SCHEMBL20155733

CC(C)On1cc2c(=O)n(C)cc(-c3cc(N)ccc3Oc3ccc(F)cc3F)c2n1

nearest known ligand 0.51

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 20/20 0.51

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
SCHEMBL20155067 0.91 BRD4 (0.52) BRD4
SCHEMBL20155587 0.87 BRD4 (0.52) BRD4
SCHEMBL20155342 0.87 BRD4 (0.51) BRD4
SCHEMBL20155607 0.85 BRD4 (0.54) BRD4
SCHEMBL20155091 0.84 BRD4 (0.49) BRD4
SCHEMBL20155689 0.83 BRD4 (0.54) BRD4
SCHEMBL20155104 0.83 BRD4 (0.64) BRD4
SCHEMBL20155105 0.83 BRD4 (0.50) BRD4
SCHEMBL20155141 0.82 BRD4 (0.49) BRD4
SCHEMBL20155047 0.81 BRD4 (0.49) 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