SCHEMBL9339463

SCHEMBL9339463

[CH2]c1cc(Oc2ccc(F)cc2)ccc1F

nearest known ligand 0.41

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
SOS1 Q07889 3/20 0.41
HSPB1 P04792 2/20 0.41
PDE4A P27815 1/20 0.39
PDE4B Q07343 1/20 0.39
PDE4C Q08493 1/20 0.39
PDE4D Q08499 1/20 0.39
SCN4A P35499 2/20 0.37
FDFT1 P37268 2/20 0.37
SCN9A Q15858 3/20 0.36
FFAR4 Q5NUL3 1/20 0.35
GAA P10253 1/20 0.35
LTA4H P09960 1/20 0.35
SLC6A2 P23975 1/20 0.35
SLC6A4 P31645 1/20 0.35
SLC6A3 Q01959 1/20 0.35
KDM4E B2RXH2 1/20 0.34
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
S1PR2 O95136 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
SCHEMBL10548663 0.86 LTA4H (0.48) SOS1FFAR4GAALTA4HMEN1
SCHEMBL10545474 0.82 FFAR4 (0.43) SCN9AFFAR4GAASLC6A2SLC6A4
SCHEMBL9340581 0.80 SOS1 (0.39) SOS1HSPB1PDE4APDE4BPDE4C
SCHEMBL10545489 0.79 PARP10 (0.47) HSPB1FDFT1GAASLC6A2SLC6A4
SCHEMBL351854 0.76 SOS1 (0.58) SOS1HSPB1PDE4APDE4BPDE4C
SCHEMBL6290683 0.76 SOS1 (0.58) SOS1HSPB1PDE4APDE4BPDE4C
SCHEMBL6289867 0.76 SOS1 (0.58) SOS1HSPB1PDE4APDE4BPDE4C
SCHEMBL9340611 0.76 HSPB1 (0.42) SOS1HSPB1SCN9ASLC6A2SLC6A4
SCHEMBL5540625 0.75 HSPB1 (0.48) SOS1HSPB1PDE4APDE4BPDE4C
SCHEMBL755034 0.74

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0317265-B1 Novel imidate insecticides ZENECA INC (US) 1994-06-01 EP disclosed
US-5089623-A Certain imidate insecticides IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1992-02-18 US disclosed
US-5070210-A Novel ketenimines as intermediates for insecticides ICI AMERICAS INC. (US) 1991-12-03 US disclosed
US-5045566-A Phenyl or naphthyl substituted ICI AMERICAS INC. (US) 1991-09-03 US disclosed
EP-0317265-A2 Novel imidate insecticides ZENECA INC. (US) 1989-05-24 EP disclosed
US-4814340-A 1,4-diaryl alkane derivatives having insecticidal and acaricidal activity MITSUI TOATSU CHEMICALS, INC. (JP) 1989-03-21 US disclosed
US-4661501-A Certain aryl-alkane-2-pyridyloxy-phenyl derivatives having insecticidal and acaricidal activity MITSUI TOATSU CHEMICALS, INC. (JP) 1987-04-28 US disclosed
US-4599362-A 2-aryl-ethyl ether derivatives and insecticidal and acaricidal agents containing said derivatives MITSUITOATSU CHEMICALS, INC. (JP) 1986-07-08 US disclosed