SCHEMBL16629289

SCHEMBL16629289

CC(C)OC(=O)OC(=O)c1cc(N(C)C(=O)OC(C)(C)C)nn1C

nearest known ligand 0.31

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 1/20 0.31

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
SCHEMBL16629284 0.79 GRN (0.49) BRD4
SCHEMBL16629273 0.78 BRD4 (0.35) BRD4
SCHEMBL29664520 0.72 BRD4 (0.36) BRD4
SCHEMBL16629274 0.69 BRD4 (0.34) BRD4
SCHEMBL18019577 0.67 BRD4 (0.35) BRD4
SCHEMBL15273735 0.66 AAK1 (0.35)
SCHEMBL22445393 0.64 CNR2 (0.32) BRD4
SCHEMBL16629271 0.64 BRD4 (0.38) BRD4
SCHEMBL21872232 0.62 BRD4 (0.36) BRD4
SCHEMBL15273681 0.62 AAK1 (0.34)

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-2015050989-A2 MACROCYCLIC COMPOUNDS FOR THE TREATMENT OF PROLIFERATIVE DISEASES CS THERAPEUTICS INC. (US) 2015-04-09 WO disclosed