SCHEMBL30872202

SCHEMBL30872202

N#Cc1ccccc1Oc1ccccc1F

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.53
GAA P10253 1/20 0.53
SLC22A12 Q96S37 2/20 0.46
EZH2 Q15910 1/20 0.43
ALDH1A1 P00352 2/20 0.42
MEN1 O00255 1/20 0.42
MAPT P10636 1/20 0.42
KMT2A Q03164 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
HTR1A P08908 4/20 0.42
SLC6A2 P23975 4/20 0.42
SLC6A3 Q01959 3/20 0.42
CXCL8 P10145 1/20 0.42
RHEB Q15382 1/20 0.41
FFAR4 Q5NUL3 1/20 0.39
MAP4K4 O95819 1/20 0.39
SLC6A4 P31645 1/20 0.39
TSHR P16473 1/20 0.39
AR P10275 1/20 0.39
ESR1 P03372 1/20 0.39

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
SCHEMBL18603934 1.00 POLB (0.53) POLBGAASLC22A12EZH2ALDH1A1
SCHEMBL7054403 0.87 GAA (0.64) POLBGAASLC22A12ALDH1A1MAP4K4
SCHEMBL4374421 0.85 AR (0.55) POLBGAASLC22A12EZH2FFAR4
SCHEMBL8431375 0.85 GAA (0.62) POLBGAASLC22A12ALDH1A1MAP4K4
SCHEMBL2389927 0.80 HTR1A (0.55) ALDH1A1MEN1KMT2AL3MBTL1HTR1A
SCHEMBL30773497 0.80 HTR1A (0.55) ALDH1A1MEN1KMT2AL3MBTL1HTR1A
SCHEMBL22904395 0.78 RHEB (0.44) SLC22A12ALDH1A1MEN1MAPTKMT2A
SCHEMBL27607640 0.78 POLB (0.71) POLBGAASLC22A12ALDH1A1MEN1
SCHEMBL9746799 0.78 KDM4E (0.54) POLBGAAMAPTAR
SCHEMBL30968574 0.78 MAPT (0.46) POLBGAASLC22A12ALDH1A1MEN1

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
CN-112979628-B Diphenyl ether substituted oxime derivative and its application in agriculture 东莞市东阳光农药研发有限公司 2024-04-26 CN disclosed