SCHEMBL16409683

SCHEMBL16409683

CN/N=C/c1ccc2c(c1)CC(/C(=N\O)c1ccc(OC(F)(F)F)cc1)C2

nearest known ligand 0.40

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
GCGR P47871 4/20 0.40
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
NPC1 O15118 1/20 0.38
MITF O75030 1/20 0.38
GAA P10253 1/20 0.38
RAB9A P51151 1/20 0.38
TRPV1 Q8NER1 2/20 0.33
BCHE P06276 1/20 0.33
ACHE P22303 1/20 0.33
BACE1 P56817 1/20 0.33
MIF P14174 1/20 0.32
PDE4B Q07343 2/20 0.32
KDM4E B2RXH2 1/20 0.31
POLB P06746 1/20 0.31
MAPT P10636 1/20 0.31
PPARD Q03181 1/20 0.31
PPARA Q07869 1/20 0.31
PDE4D Q08499 1/20 0.31

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
SCHEMBL16563928 0.70 HSD11B1 (0.43) NPC1RAB9ATRPV1MAPT
SCHEMBL16563927 0.70 HSD11B1 (0.43) NPC1RAB9ATRPV1MAPT
SCHEMBL16409682 0.66 GCGR (0.33) GCGRMEN1KMT2ANPC1MITF
SCHEMBL16563277 0.65 EPHX2 (0.43) GAA
SCHEMBL16563275 0.65 EPHX2 (0.43) GAA
SCHEMBL16409697 0.64 KDM4E (0.46) GCGRMEN1KMT2ANPC1MITF
SCHEMBL2166800 0.60 KMT2A (0.49) GCGRMEN1KMT2ANPC1MITF
SCHEMBL2743367 0.60 KMT2A (0.49) GCGRMEN1KMT2ANPC1MITF
SCHEMBL2166803 0.60 KMT2A (0.49) GCGRMEN1KMT2ANPC1MITF
SCHEMBL16039805 0.59 RAB9A (0.62) GCGRMEN1KMT2ANPC1MITF

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-2015007682-A1 PESTICIDE COMPOUNDS BASF SE (DE) 2015-01-22 WO disclosed