SCHEMBL1006580

SCHEMBL1006580

BrCCCCCCCCC1CC2C=CC1C2

nearest known ligand 0.39

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 6/20 0.39
ALDH1A1 P00352 3/20 0.39
TSHR P16473 1/20 0.34
EPHX2 P34913 2/20 0.33
MEN1 O00255 2/20 0.32
KMT2A Q03164 2/20 0.32
HTT P42858 1/20 0.32
TDP1 Q9NUW8 1/20 0.30

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
SCHEMBL1006797 1.00 KDM4E (0.39) KDM4EALDH1A1TSHREPHX2MEN1
SCHEMBL988884 1.00 KDM4E (0.39) KDM4EALDH1A1TSHREPHX2MEN1
SCHEMBL969368 0.98 KDM4E (0.40) KDM4EALDH1A1TSHREPHX2MEN1
SCHEMBL1006307 0.92 KDM4E (0.41) KDM4EALDH1A1TSHREPHX2MEN1
SCHEMBL30996063 0.90 KDM4E (0.44) KDM4EALDH1A1TSHREPHX2MEN1
SCHEMBL4445579 0.90 KDM4E (0.44) KDM4EALDH1A1TSHREPHX2MEN1
SCHEMBL1975023 0.88 KDM4E (0.46) KDM4EALDH1A1TSHREPHX2MEN1
SCHEMBL1054886 0.84 KDM4E (0.43) KDM4EALDH1A1TSHREPHX2MEN1
SCHEMBL19689468 0.83 KDM4E (0.46) KDM4EALDH1A1TSHREPHX2MEN1
SCHEMBL6260191 0.81 KDM4E (0.46) KDM4EALDH1A1TSHREPHX2MEN1

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-20110020731-A1 POLYMER ELECTROLYTE COMPOSITION SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2011-01-27 US disclosed
EP-2270104-A1 POLYMER ELECTROLYTE COMPOSITION Sumitomo Chemical Company, Limited (JP) 2011-01-05 EP disclosed