SCHEMBL20135830

SCHEMBL20135830

CCS(=O)(=O)Nc1ccc(Oc2ccc(F)cc2F)c(-c2cn(C)c(=O)cc2OCC2CCN(C(=O)O)CC2)c1

nearest known ligand 0.70

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 20/20 0.70

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
SCHEMBL15539767 0.92 BRD4 (0.81) BRD4
SCHEMBL15551534 0.91 BRD4 (0.68) BRD4
SCHEMBL15552612 0.90 BRD4 (0.75) BRD4
SCHEMBL15540306 0.89 BRD4 (0.75) BRD4
SCHEMBL15541486 0.88 BRD4 (0.75) BRD4
SCHEMBL15539424 0.85 BRD4 (0.73) BRD4
SCHEMBL15539146 0.83 BRD4 (1.00) BRD4
SCHEMBL15537548 0.82 BRD4 (0.86) BRD4
SCHEMBL15541223 0.82 BRD4 (0.72) BRD4
SCHEMBL15541302 0.81 BRD4 (1.00) 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
EP-2858990-B1 PYRIDINONE AND PYRIDAZINONE DERIVATIVES ABBVIE INC (US) 2018-05-16 EP claimed