SCHEMBL363643

SCHEMBL363643

Cc1ccccc1C(CC=NO)(c1ccc(Br)cc1)c1ccnc2cc(Cl)ccc12

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 7/20 0.39
POLB P06746 5/20 0.39
LMNA P02545 4/20 0.39
NPSR1 Q6W5P4 4/20 0.39
XBP1 P17861 3/20 0.39
KDM4E B2RXH2 3/20 0.39
PLA2G1B P04054 2/20 0.39
ATG4B Q9Y4P1 2/20 0.39
ALDH1A1 P00352 1/20 0.39
HTT P42858 1/20 0.39
RECQL P46063 1/20 0.39
MCL1 Q07820 1/20 0.39
KMT2A Q03164 6/20 0.38
MEN1 O00255 4/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
L3MBTL1 Q9Y468 2/20 0.38
USP2 O75604 1/20 0.38
OPRM1 P35372 2/20 0.35
OPRD1 P41143 2/20 0.35
TLR8 Q9NR97 1/20 0.34

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
SCHEMBL362879 0.82 MAPK1 (0.30)
SCHEMBL361805 0.81
SCHEMBL363962 0.78
SCHEMBL364581 0.78
SCHEMBL363295 0.77
SCHEMBL363808 0.76
SCHEMBL363841 0.76
SCHEMBL363425 0.76 KCNH2 (0.32)
SCHEMBL365144 0.76 KCNH2 (0.32)
SCHEMBL362890 0.75

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-2593426-A1 1-HYDROXYIMINO-3-PHENYL-PROPANES F.HOFFMANN-LA ROCHE AG (CH) 2013-05-22 EP claimed
WO-2012007365-A1 1-HYDROXYIMINO-3-PHENYL-PROPANES F. HOFFMANN-LA ROCHE AG (CH) 2012-01-19 WO claimed
EP-2593426-A1 1-HYDROXYIMINO-3-PHENYL-PROPANES F.HOFFMANN-LA ROCHE AG (CH) 2013-05-22 EP disclosed
WO-2012007365-A1 1-HYDROXYIMINO-3-PHENYL-PROPANES F. HOFFMANN-LA ROCHE AG (CH) 2012-01-19 WO disclosed