SCHEMBL28294744

SCHEMBL28294744

O=CCCCC1C=CCCC1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
USP2 O75604 1/20 0.36
ALDH1A1 P00352 1/20 0.36
ALOX15 P16050 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
HIF1A Q16665 1/20 0.32
PSMB11 A5LHX3 1/20 0.31
PSMA7 O14818 1/20 0.31
PSMB1 P20618 1/20 0.31
PSMA1 P25786 1/20 0.31
PSMA2 P25787 1/20 0.31
PSMA3 P25788 1/20 0.31
PSMA4 P25789 1/20 0.31
PSMB8 P28062 1/20 0.31
PSMB9 P28065 1/20 0.31
PSMA5 P28066 1/20 0.31
PSMB4 P28070 1/20 0.31
PSMB6 P28072 1/20 0.31
PSMB5 P28074 1/20 0.31
PSMB10 P40306 1/20 0.31
PSMB3 P49720 1/20 0.31

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
SCHEMBL10582645 0.83 USP2 (0.46) USP2ALDH1A1ALOX15TDP1HIF1A
SCHEMBL16399326 0.81 USP2 (0.49) USP2ALDH1A1ALOX15TDP1HIF1A
SCHEMBL16398725 0.81 USP2 (0.49) USP2ALDH1A1ALOX15TDP1HIF1A
SCHEMBL8199466 0.77 USP2 (0.33) USP2ALDH1A1ALOX15TDP1PSMB11
SCHEMBL9321577 0.76 ADH1B (0.33)
SCHEMBL28122676 0.76
SCHEMBL4285573 0.76
SCHEMBL7998095 0.75 USP2 (0.35) USP2ALDH1A1ALOX15TDP1PSMB11
SCHEMBL60993 0.75 USP2 (0.41) USP2ALDH1A1ALOX15TDP1PSMB11
SCHEMBL7992361 0.75 USP2 (0.35) USP2ALDH1A1ALOX15TDP1PSMB11

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109725065-A The analysis method of sulfur alcohol compound in a kind of light oil 中国石油化工股份有限公司 2019-05-07 CN claimed
CN-109725069-A A kind of analysis method of light oil 中国石油化工股份有限公司 2019-05-07 CN claimed
CN-109725065-A The analysis method of sulfur alcohol compound in a kind of light oil 中国石油化工股份有限公司 2019-05-07 CN disclosed
CN-109725069-A A kind of analysis method of light oil 中国石油化工股份有限公司 2019-05-07 CN disclosed