SCHEMBL11005476

SCHEMBL11005476

NOC(c1ccccc1)C(F)(F)F

nearest known ligand 0.50

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 12/20 0.46
TDO2 P48775 10/20 0.46
NPSR1 Q6W5P4 2/20 0.40
L3MBTL1 Q9Y468 2/20 0.40
GAA P10253 1/20 0.40
MAPK1 P28482 1/20 0.39

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
SCHEMBL11568803 0.81 NPSR1 (0.41) IDO1TDO2NPSR1L3MBTL1GAA
SCHEMBL7715366 0.77 NPSR1 (0.43) IDO1TDO2NPSR1L3MBTL1GAA
SCHEMBL12199965 0.77 NPSR1 (0.43) IDO1TDO2NPSR1L3MBTL1GAA
SCHEMBL15579767 0.77 NPSR1 (0.40) IDO1TDO2NPSR1L3MBTL1GAA
SCHEMBL15579764 0.77 NPSR1 (0.40) IDO1TDO2NPSR1L3MBTL1GAA
SCHEMBL12199974 0.77 NPSR1 (0.43) IDO1TDO2NPSR1L3MBTL1GAA
SCHEMBL11444511 0.76 NPSR1 (0.39) IDO1TDO2NPSR1L3MBTL1GAA
SCHEMBL1843244 0.75 NPSR1 (0.36) IDO1TDO2NPSR1L3MBTL1GAA
SCHEMBL21725624 0.74 NPSR1 (0.41) NPSR1L3MBTL1GAAMAPK1
SCHEMBL21725638 0.74 NPSR1 (0.41) NPSR1L3MBTL1GAAMAPK1

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
US-4517183-A COMBATING DISEASES WITH WEAKNESS OF IMMUNE SYSTEMS BOEHRINGER MANNHEIM GMBH (DE) 1985-05-14 US disclosed