SCHEMBL10549006

SCHEMBL10549006

N#CCc1ccc(F)c(Oc2ccc(F)cc2)c1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC6A4 P31645 5/20 0.38
HTR2A P28223 3/20 0.38
KCNH2 Q12809 2/20 0.38
SLC6A2 P23975 2/20 0.38
SLC6A3 Q01959 2/20 0.38
FFAR1 O14842 1/20 0.37
AR P10275 1/20 0.36
CYP1A2 P05177 1/20 0.35
CYP3A4 P08684 1/20 0.35
CYP2C19 P33261 1/20 0.35
GAA P10253 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
PTGER4 P35408 2/20 0.34
PTGER2 P43116 1/20 0.34
HSPB1 P04792 2/20 0.34
MAPT P10636 1/20 0.34
ALOX5 P09917 1/20 0.34
CARM1 Q86X55 1/20 0.33
PRMT6 Q96LA8 1/20 0.33
HTR1A P08908 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
SCHEMBL10545055 0.89 HTR2A (0.43) SLC6A4HTR2AKCNH2FFAR1AR
SCHEMBL10547581 0.88 AR (0.41) SLC6A4HTR2AKCNH2SLC6A2SLC6A3
SCHEMBL10549585 0.88 MAOA (0.38) SLC6A4SLC6A2SLC6A3FFAR1GAA
SCHEMBL10549385 0.88 PKM (0.43) ARGAAL3MBTL1MAPT
SCHEMBL11036206 0.88 SRD5A2 (0.41) SLC6A4HTR2AFFAR1LTA4HEPHX2
SCHEMBL2362687 0.88 TTR (0.41) SLC6A4HTR2AFFAR1LTA4H
SCHEMBL10547267 0.85 CACNA1C (0.43) SLC6A4SLC6A2SLC6A3FFAR1AR
SCHEMBL10546229 0.85 HTR2A (0.40) SLC6A4HTR2AKCNH2ARCYP1A2
SCHEMBL10544400 0.84 SLC6A4 (0.38) SLC6A4HTR2AKCNH2SLC6A2SLC6A3
SCHEMBL10550065 0.84 FNTA (0.46) SLC6A4SLC6A2SLC6A3FFAR1HTR1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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