SCHEMBL19930860

SCHEMBL19930860

Cn1cc(-c2nc(N)ncc2OCC2CC2)c2ccoc2c1=O

nearest known ligand 0.42

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 18/20 0.42
TLR9 Q9NR96 2/20 0.38
TLR8 Q9NR97 2/20 0.38
TLR7 Q9NYK1 2/20 0.38
BRD2 P25440 1/20 0.36
BRD3 Q15059 1/20 0.36
BRDT Q58F21 1/20 0.36

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
SCHEMBL16650799 0.86 BRD4 (0.45) BRD4BRD2BRD3BRDT
SCHEMBL19930665 0.85 BRD4 (0.46) BRD4TLR9TLR8TLR7
SCHEMBL25043222 0.83 BRD4 (0.41) BRD4
SCHEMBL16651237 0.83 BRD4 (0.46) BRD4BRD2BRD3BRDT
SCHEMBL25043223 0.82 BRD4 (0.40) BRD4
SCHEMBL29848879 0.81 BRD4 (0.46) BRD4BRD2BRD3BRDT
SCHEMBL16650344 0.81 BRD4 (0.46) BRD4BRD2BRD3BRDT
SCHEMBL21916713 0.81 BRD4 (0.51) BRD4TLR9TLR8TLR7
SCHEMBL19931211 0.80 BRD4 (0.40) BRD4
SCHEMBL16658311 0.80 BRD4 (0.47) 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4134364-A2 BROMODOMAIN INHIBITORS Celgene Quanticel Research, Inc. (US) 2023-02-15 EP disclosed
EP-3640241-A1 BROMODOMAIN INHIBITORS Celgene Quanticel Research, Inc. (US) 2020-04-22 EP disclosed
EP-3290407-A1 BROMODOMAIN INHIBITORS Celgene Quanticel Research, Inc (US) 2018-03-07 EP disclosed