SCHEMBL20155530

SCHEMBL20155530

CCSNc1ccc(Oc2ccc(C#N)cc2F)c(C2=CN(C)C(=O)/C(=C/NC)C2=N)c1

nearest known ligand 0.37

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 7/20 0.37

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
SCHEMBL20155693 0.89 BRD4 (0.36) BRD4
SCHEMBL20155144 0.88 BRD4 (0.35) BRD4
SCHEMBL20155487 0.85 BRD4 (0.33) BRD4
SCHEMBL20155383 0.83 BRD4 (0.35) BRD4
SCHEMBL20155372 0.83 BRD4 (0.39) BRD4
SCHEMBL20155340 0.83 BRD4 (0.40) BRD4
SCHEMBL20155690 0.81 BRD4 (0.38) BRD4
SCHEMBL20155097 0.81 BRD4 (0.37) BRD4
SCHEMBL20155005 0.77 BRD4 (0.54) BRD4
SCHEMBL20155443 0.77 BRD4 (0.54) 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