SCHEMBL6928507

SCHEMBL6928507

BrCc1ccc2cc[nH]c2n1

nearest known ligand 0.50

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CCR1 P32246 1/20 0.50
AXL P30530 2/20 0.41
NUDT1 P36639 1/20 0.41
BRD4 O60885 1/20 0.36
APP P05067 1/20 0.34
MAPK1 P28482 2/20 0.33
AHR P35869 1/20 0.32
CDK8 P49336 1/20 0.31
PRKCI P41743 1/20 0.31
ELANE P08246 1/20 0.30
PIK3CD O00329 1/20 0.30
PIK3CA P42336 1/20 0.30
PIK3CB P42338 1/20 0.30
PIK3CG P48736 1/20 0.30

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
SCHEMBL4167148 0.79 AXL (0.41) AXLNUDT1BRD4APPMAPK1
SCHEMBL6929283 0.79 CCR1 (0.50) CCR1AXLNUDT1BRD4APP
SCHEMBL31283256 0.79 AXL (0.41) AXLNUDT1BRD4APPMAPK1
Hydrochloric Acid SCHEMBL4976930 0.78 AXL (0.39) AXLNUDT1BRD4APPCDK8
SCHEMBL12874655 0.77 KCNH2 (0.43) AXLNUDT1BRD4APPAHR
SCHEMBL11888031 0.76 AXL (0.38) AXLNUDT1BRD4APPPIK3CD
SCHEMBL12807007 0.76 KCNH2 (0.50) AXLNUDT1BRD4
SCHEMBL10130905 0.75 AXL (0.37) AXLNUDT1BRD4APPMAPK1
SCHEMBL5925823 0.75 AXL (0.37) AXLNUDT1BRD4APP
SCHEMBL18430380 0.75 AXL (0.37) AXLNUDT1BRD4APPMAPK1

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-2011012622-A1 BENZOXAZINONE DERIVATIVES FOR THE TREATMENT OF GLYTL MEDIATED DISORDERS GLAXO GROUP LIMITED (GB) 2011-02-03 WO disclosed