SCHEMBL15538004

SCHEMBL15538004

CCS(=O)(=O)Nc1ccc(Oc2ccc(F)cc2F)c(-c2c[nH]c(=O)c(C)c2)c1

nearest known ligand 0.64

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 20/20 0.64
EP300 Q09472 3/20 0.64
BRD2 P25440 1/20 0.56
ADORA2B P29275 1/20 0.56
TSPO P30536 1/20 0.56
BRD3 Q15059 1/20 0.56
BRDT Q58F21 1/20 0.56

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
SCHEMBL15537592 0.90 BRD4 (0.62) BRD4EP300
SCHEMBL15558963 0.83 BRD4 (0.61) BRD4EP300BRD2ADORA2BTSPO
SCHEMBL21904838 0.82 BRD4 (0.64) BRD4EP300BRD2ADORA2BTSPO
SCHEMBL15538108 0.82 BRD4 (0.62) BRD4EP300
SCHEMBL15538799 0.82 BRD4 (0.53) BRD4EP300
SCHEMBL16650688 0.82 BRD4 (0.66) BRD4EP300BRD2ADORA2BTSPO
SCHEMBL16654653 0.81 BRD4 (0.63) BRD4EP300BRD2ADORA2BTSPO
SCHEMBL28720367 0.81 BRD4 (0.65) BRD4EP300BRD2ADORA2BTSPO
SCHEMBL29548942 0.81 BRD4 (0.65) BRD4EP300BRD2ADORA2BTSPO
SCHEMBL16654565 0.80 BRD4 (0.61) BRD4EP300BRD2ADORA2BTSPO

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 9 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2858982-A1 PYRIDINONE AND PYRIDAZINONE DERIVATIVES AbbVie Inc. (US) 2015-04-15 EP claimed
EP-2858990-A1 PYRIDINONE AND PYRIDAZINONE DERIVATIVES AbbVie Inc. (US) 2015-04-15 EP claimed
WO-2013185284-A1 PYRIDINONE AND PYRIDAZINONE DERIVATIVES ABBOTT LABORATORIES (US) 2013-12-19 WO claimed
WO-2013188381-A1 PYRIDINONE AND PYRIDAZINONE DERIVATIVES ABBVIE INC. (US) 2013-12-19 WO claimed
EP-2858990-B1 PYRIDINONE AND PYRIDAZINONE DERIVATIVES ABBVIE INC (US) 2018-05-16 EP disclosed
EP-2858982-A1 PYRIDINONE AND PYRIDAZINONE DERIVATIVES AbbVie Inc. (US) 2015-04-15 EP disclosed
EP-2858990-A1 PYRIDINONE AND PYRIDAZINONE DERIVATIVES AbbVie Inc. (US) 2015-04-15 EP disclosed
WO-2013188381-A1 PYRIDINONE AND PYRIDAZINONE DERIVATIVES ABBVIE INC. (US) 2013-12-19 WO disclosed
WO-2013185284-A1 PYRIDINONE AND PYRIDAZINONE DERIVATIVES ABBOTT LABORATORIES (US) 2013-12-19 WO disclosed