SCHEMBL6023919

SCHEMBL6023919

O=[C]c1ccc(Nc2ccc(F)cc2F)cc1Cl

nearest known ligand 0.49

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
SOS1 Q07889 1/20 0.48
MAPK14 Q16539 9/20 0.45
MAPK13 O15264 1/20 0.41
MAPK12 P53778 1/20 0.41
MAPK11 Q15759 1/20 0.41
CNR1 P21554 1/20 0.40
CNR2 P34972 1/20 0.40
IDO1 P14902 1/20 0.40
TDO2 P48775 1/20 0.40
APP P05067 1/20 0.38
MAPT P10636 1/20 0.38

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
SCHEMBL96822 0.77 CYP11B2 (0.36)
SCHEMBL15515147 0.72 MAPT (0.53) SOS1MAPK14MAPK13MAPK12MAPK11
SCHEMBL27145735 0.71 SOS1 (0.50) SOS1MAPK14CNR1CNR2APP
SCHEMBL22563177 0.71 LRRK2 (0.42) MAPK14CNR1CNR2
SCHEMBL21468597 0.70 SOS1 (0.53) SOS1MAPK14APPMAPT
SCHEMBL12483334 0.70 LMNA (0.51) SOS1MAPK14MAPK13MAPK12MAPK11
SCHEMBL96914 0.69 CES2 (0.43) IDO1
SCHEMBL2199363 0.69 MAPK14 (0.56) SOS1MAPK14MAPK13MAPK12MAPK11
SCHEMBL7232413 0.69 SLC22A12 (0.37) IDO1
SCHEMBL28924001 0.67 SOS1 (0.63) SOS1MAPK14CNR1CNR2APP

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1658263-A1 NOVEL AMINOBENZOPHENONE COMPOUNDS Leo Pharma A/S (DK) 2006-05-24 EP disclosed
WO-2005009940-A1 NOVEL AMINOBENZOPHENONE COMPOUNDS LEO PHARMA A/S (DK) 2005-02-03 WO disclosed