SCHEMBL15549841

SCHEMBL15549841

Cn1cc(-c2cc(N)ccc2Oc2ccc(C(F)(F)F)cc2)ccc1=O

nearest known ligand 0.51

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 8/20 0.51
SOS1 Q07889 4/20 0.42
L3MBTL1 Q9Y468 2/20 0.41
RAB9A P51151 1/20 0.41
SCN9A Q15858 4/20 0.40
LMNA P02545 1/20 0.39
MAPT P10636 1/20 0.39
ATM Q13315 1/20 0.39
KIF11 P52732 1/20 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
SCHEMBL15551540 0.88 BRD4 (0.51) BRD4SOS1L3MBTL1SCN9AMAPT
SCHEMBL15551236 0.87 BRD4 (0.57) BRD4
SCHEMBL15551393 0.85 BRD4 (0.54) BRD4SCN9AMAPT
SCHEMBL15550954 0.84 BRD4 (0.71) BRD4
SCHEMBL15550335 0.83 BRD4 (0.47) BRD4RAB9ALMNAMAPTATM
SCHEMBL15550585 0.82 BRD4 (0.51) BRD4SOS1
SCHEMBL15539399 0.81 SLC6A2 (0.55) BRD4KIF11
SCHEMBL15550331 0.81 BRD4 (0.50) BRD4SOS1
SCHEMBL15553263 0.80 BRD4 (0.58) BRD4L3MBTL1LMNAMAPTATM
SCHEMBL15550848 0.80 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 4 patents. claimed = in the patent's claims; disclosed = body only.

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