SCHEMBL6516930

SCHEMBL6516930

[CH]1CCCCCC(CCC2CCCC[CH]CCCCC2)CCCC1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.44
SIGMAR1 Q99720 3/20 0.41
METAP1 P53582 1/20 0.38
NFE2L2 Q16236 1/20 0.35
HPGD P15428 2/20 0.34
DAO P14920 2/20 0.34
CHRM5 P08912 2/20 0.33
KDM4E B2RXH2 1/20 0.33
MEN1 O00255 1/20 0.33
USP2 O75604 1/20 0.33
ALDH1A1 P00352 1/20 0.33
LMNA P02545 1/20 0.33
MAPT P10636 1/20 0.33
ALOX15 P16050 1/20 0.33
ALOX12 P18054 1/20 0.33
BRCA1 P38398 1/20 0.33
HTT P42858 1/20 0.33
RECQL P46063 1/20 0.33
KMT2A Q03164 1/20 0.33
HSD17B10 Q99714 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
SCHEMBL6520301 1.00 CYP1A2 (0.44) CYP1A2SIGMAR1METAP1NFE2L2HPGD
SCHEMBL6524227 1.00 CYP1A2 (0.44) CYP1A2SIGMAR1METAP1NFE2L2HPGD
SCHEMBL6518884 1.00 CYP1A2 (0.44) CYP1A2SIGMAR1METAP1NFE2L2HPGD
SCHEMBL6517968 0.94 CYP1A2 (0.39) CYP1A2SIGMAR1METAP1NFE2L2HPGD
SCHEMBL6518515 0.90 CYP1A2 (0.52) CYP1A2SIGMAR1
SCHEMBL4358424 0.90 CYP1A2 (0.52) CYP1A2SIGMAR1
SCHEMBL6525950 0.90 CYP1A2 (0.52) CYP1A2SIGMAR1
SCHEMBL6522113 0.90 CYP1A2 (0.52) CYP1A2SIGMAR1
SCHEMBL6523849 0.90 CYP1A2 (0.52) CYP1A2SIGMAR1
SCHEMBL6523071 0.84 CYP1A2 (0.46) CYP1A2SIGMAR1

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-8487071-B2 Polyether polymer and production process thereof SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2013-07-16 US disclosed
US-20110065889-A1 POLYETHER POLYMER AND PRODUCTION PROCESS THEREOF SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2011-03-17 US disclosed