SCHEMBL7521585

SCHEMBL7521585

COc1ccc(F)c(C)c1Br

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TUBB1 Q9H4B7 3/20 0.41
ACHE P22303 1/20 0.37
LMNA P02545 1/20 0.36
MAPK1 P28482 1/20 0.36
HTT P42858 1/20 0.36
RAB9A P51151 1/20 0.36
KDM4E B2RXH2 1/20 0.34
MEN1 O00255 1/20 0.34
POLB P06746 1/20 0.34
GAA P10253 1/20 0.34
MAPT P10636 1/20 0.34
PKM P14618 1/20 0.34
KMT2A Q03164 1/20 0.34
ALDH1A1 P00352 2/20 0.33
KDM1A O60341 2/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
NFE2L2 Q16236 1/20 0.33
NQO2 P16083 1/20 0.33
NCEH1 Q6PIU2 1/20 0.33

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
SCHEMBL755549 0.81 ACHE (0.42) ACHEKDM4EMEN1POLBGAA
SCHEMBL30829726 0.80 HTR2A (0.41) TUBB1ACHELMNAMAPK1HTT
SCHEMBL4300328 0.80 HTR2A (0.41) TUBB1ACHELMNAMAPK1HTT
SCHEMBL29449512 0.79 TUBB1 (0.44) TUBB1ACHELMNAMAPK1HTT
SCHEMBL19386524 0.79 TUBB1 (0.44) TUBB1ACHELMNAMAPK1HTT
SCHEMBL25087577 0.77 NCEH1 (0.52) TUBB1ACHEKDM4EMEN1POLB
SCHEMBL8071106 0.77 NQO2 (0.43) TUBB1ACHELMNAMAPK1RAB9A
SCHEMBL8240850 0.77 TUBB1 (0.43) TUBB1ACHELMNAMAPK1HTT
SCHEMBL25937354 0.77 ERN1 (0.42) TUBB1LMNAMAPK1HTTRAB9A
SCHEMBL23647861 0.77 MAPT (0.44) TUBB1LMNAMAPK1HTTRAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1300084-C 2-methoxy diphenyl ketone compound intermediate and its preparation method AMERICAN CYANAMID CO (US) 2007-02-14 CN disclosed
CN-1495153-A 2-methoxy diphenyl ketone compound intermediate and its preparation method 2004-05-12 CN disclosed
CN-1147456-C Fungicidal 2-methoxybenzophenones 2004-04-28 CN disclosed
EP-0897904-B1 Fungicidal 2-methoxybenzophenones BASF AG (DE) 2002-02-20 EP disclosed
CN-1217317-A Fungicidal 2-methoxybenzophenones AMERICAN CYANAMID CO (US) 1999-05-26 CN disclosed
EP-0897904-A1 Fungicidal 2-methoxybenzophenones American Cyanamid Company (US) 1999-02-24 EP disclosed