SCHEMBL20020177

SCHEMBL20020177

Cc1cc(COCCCCCc2ccccc2)on1

nearest known ligand 0.51

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.51
KMT2A Q03164 2/20 0.51
TDP1 Q9NUW8 2/20 0.50
L3MBTL1 Q9Y468 1/20 0.50
ALDH1A1 P00352 1/20 0.46
BRD4 O60885 1/20 0.41
NAAA Q02083 1/20 0.37
SLC6A2 P23975 1/20 0.37
SLC6A4 P31645 1/20 0.37
SLC6A3 Q01959 1/20 0.37
KCNH2 Q12809 1/20 0.37
MAPK1 P28482 1/20 0.37
SPHK1 Q9NYA1 1/20 0.37

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
SCHEMBL20020227 0.89 MEN1 (0.56) MEN1KMT2ATDP1ALDH1A1BRD4
SCHEMBL20020199 0.82 MEN1 (0.50) MEN1KMT2ATDP1L3MBTL1ALDH1A1
SCHEMBL15931955 0.82 TDP1 (0.47) MEN1KMT2ATDP1L3MBTL1SPHK1
SCHEMBL15932115 0.81 MEN1 (0.43) MEN1KMT2ATDP1L3MBTL1
SCHEMBL15932113 0.80 TDP1 (0.48) MEN1KMT2ATDP1L3MBTL1MAPK1
SCHEMBL20507231 0.79 MEN1 (0.50) MEN1KMT2ATDP1L3MBTL1ALDH1A1
SCHEMBL15931787 0.79 SMN1; SMN2 (0.44) MEN1KMT2ATDP1L3MBTL1MAPK1
SCHEMBL20020121 0.78 TDP1 (0.47) MEN1KMT2ATDP1L3MBTL1SPHK1
SCHEMBL11032320 0.76 MEN1 (0.51) MEN1KMT2ATDP1L3MBTL1ALDH1A1
SCHEMBL15932111 0.76 TDP1 (0.49) MEN1KMT2ATDP1L3MBTL1ALDH1A1

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
EP-2952096-B1 Amide compound, an arthropod pest control agent and a method for controlling arthropod pest SUMITOMO CHEMICAL CO (JP) 2018-04-04 EP disclosed