SCHEMBL9338779

SCHEMBL9338779

[CH2]c1ccc(Cl)c(Oc2ccc(F)cc2)c1

nearest known ligand 0.39

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 8/20 0.39
SLC6A4 P31645 8/20 0.39
KCNH2 Q12809 8/20 0.39
F2 P00734 1/20 0.37
F10 P00742 1/20 0.37
HSPB1 P04792 1/20 0.36
HTR2C P28335 3/20 0.36
HTR2B P41595 3/20 0.36
SCN9A Q15858 1/20 0.36
ALDH1A1 P00352 1/20 0.36
LMNA P02545 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
SCN8A Q9UQD0 1/20 0.35
SCN10A Q9Y5Y9 1/20 0.35

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
SCHEMBL9340374 0.81 SLC6A4 (0.40) HTR2ASLC6A4KCNH2HSPB1HTR2C
SCHEMBL10546106 0.81 CYP1A2 (0.44) ALDH1A1LMNA
SCHEMBL16695420 0.79 SLC6A4 (0.46) HTR2ASLC6A4KCNH2F2F10
SCHEMBL1028660 0.79 ESR1 (0.44) HTR2ASLC6A4KCNH2F2F10
SCHEMBL1028659 0.79 HTR2A (0.47) HTR2ASLC6A4KCNH2ALDH1A1L3MBTL1
SCHEMBL9343286 0.76 KDM4E (0.44) HTR2ASLC6A4KCNH2SCN9AALDH1A1
SCHEMBL2810063 0.75 SLC6A4 (0.46) HTR2ASLC6A4KCNH2F2F10
SCHEMBL2812244 0.75 MAOB (0.47) HTR2ASLC6A4KCNH2F2F10
SCHEMBL9340581 0.74 SOS1 (0.39) HTR2ASLC6A4KCNH2HSPB1SCN9A
SCHEMBL5540625 0.74 HSPB1 (0.48) HSPB1SCN9AALDH1A1LMNAL3MBTL1

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 13 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-5070097-A MITICIDES ICI AMERICAS INC. (US) 1991-12-03 US disclosed
US-5064846-A Heterocyclic insecticides ICI AMERICAS INC. (US) 1991-11-12 US disclosed
US-5045566-A Phenyl or naphthyl substituted ICI AMERICAS INC. (US) 1991-09-03 US disclosed
US-4994473-A For plants ICI AMERICAS INC. (US) 1991-02-19 US disclosed
US-4994488-A Controlling Lepidoptera ICI AMERICAS INC. (US) 1991-02-19 US disclosed
EP-0317265-A2 Novel imidate insecticides ZENECA INC. (US) 1989-05-24 EP disclosed
EP-0317259-A2 Heterocyclic insecticides ICI AMERICAS 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