SCHEMBL11215946

SCHEMBL11215946

FC(F)(F)Oc1ccc(C(Br)Br)cc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE2A O00408 1/20 0.49
ALDH1A1 P00352 3/20 0.44
MAPT P10636 3/20 0.42
EPHX2 P34913 1/20 0.42
GPR3 P46089 1/20 0.39
SLC7A5 Q01650 2/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
KDM4E B2RXH2 1/20 0.38
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
SLC6A2 P23975 1/20 0.38
SLC6A4 P31645 1/20 0.38
SLC6A3 Q01959 1/20 0.38
HTT P42858 1/20 0.38
RAB9A P51151 1/20 0.38
KIF11 P52732 1/20 0.37
NISCH Q9Y2I1 1/20 0.37
TOP2A P11388 1/20 0.36
TOP2B Q02880 1/20 0.36
MAOB P27338 1/20 0.36

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
SCHEMBL646645 0.86 PDE2A (0.49) PDE2AALDH1A1MAPTEPHX2GPR3
SCHEMBL1676518 0.83 PDE2A (0.54) PDE2AALDH1A1MAPTEPHX2L3MBTL1
SCHEMBL2092438 0.82 PDE2A (0.49) PDE2AALDH1A1MAPTEPHX2GPR3
SCHEMBL254957 0.80 MAPT (0.56) PDE2AALDH1A1MAPTEPHX2GPR3
SCHEMBL16563355 0.79 PDE2A (0.47) PDE2AALDH1A1MAPTEPHX2GPR3
SCHEMBL3484598 0.79 PDE2A (0.50) PDE2AALDH1A1MAPTEPHX2GPR3
SCHEMBL1046493 0.78 PDE2A (0.54) PDE2AALDH1A1MAPTEPHX2L3MBTL1
SCHEMBL19946330 0.78 PDE2A (0.46) PDE2AALDH1A1MAPTEPHX2GPR3
SCHEMBL21497149 0.78 PDE2A (0.42) PDE2AALDH1A1MAPTEPHX2GPR3
SCHEMBL4533986 0.78 PDE2A (0.50) PDE2AALDH1A1SLC7A5L3MBTL1TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0008854-B1 PENTADIENONE HYDRAZONE, AND ITS USE AS INSECTICIDAL AGENT AMERICAN CYANAMID COMPANY (US) 1983-03-09 EP disclosed
EP-0008854-A1 Pentadienone hydrazone, and its use as insecticidal agent AMERICAN CYANAMID COMPANY (US) 1980-03-19 EP disclosed
US-4191768-A Pentadienone hydrazones, method for preparing the same, and insecticidal use thereof AMERICAN CYANAMID COMPANY (US) 1980-03-04 US disclosed