Benzene

Benzene

SCHEMBL28050653

CCCCCCCCCCCCC(O)C[O].c1ccccc1

nearest known ligand 0.59

Full drug profile on Sugi Atlas →

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
GPR84 Q9NQS5 8/20 0.59
FFAR1 O14842 2/20 0.57
FFAR4 Q5NUL3 1/20 0.57
FAAH O00519 2/20 0.46
PSMD14 O00487 2/20 0.46
PLA2G1B P04054 2/20 0.46
MMP2 P08253 2/20 0.46
ATG4B Q9Y4P1 2/20 0.46
HSP90AA1 P07900 1/20 0.46
RAD52 P43351 1/20 0.46
NFKB1 P19838 1/20 0.46
MAPT P10636 1/20 0.45
LCK P06239 1/20 0.45
PPARD Q03181 1/20 0.45
ZDHHC20 Q5W0Z9 1/20 0.45
ZDHHC2 Q9UIJ5 1/20 0.45

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
SCHEMBL29090021 0.93 GPR84 (0.59) GPR84FFAR1FFAR4PSMD14PLA2G1B
SCHEMBL28577980 0.93 GPR84 (0.59) GPR84FFAR1FFAR4PSMD14PLA2G1B
SCHEMBL533870 0.93 GPR84 (0.59) GPR84FFAR1FFAR4PSMD14PLA2G1B
SCHEMBL9856655 0.93 GPR84 (0.59) GPR84FFAR1FFAR4PSMD14PLA2G1B
SCHEMBL1869680 0.93 GPR84 (0.59) GPR84FFAR1FFAR4PSMD14PLA2G1B
SCHEMBL1875853 0.91
Benzene SCHEMBL28241104 0.84 FFAR1 (0.63) GPR84FFAR1FFAR4FAAHNFKB1
Benzene SCHEMBL6671957 0.84 FFAR1 (0.63) GPR84FFAR1FFAR4FAAHNFKB1
SCHEMBL2381697 0.84
SCHEMBL2381278 0.84

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-105294408-B Cation light initiator(2 hydroxy-tetradecyl oxygen phenyl)The preparation method of benzene iodine hexafluoro antimonate 上海予利生物科技股份有限公司 2017-12-26 CN claimed
CN-105294408-A Preparation method for cationic photoinitiator (2-hydroxytetradecyloxyphenyl) phenyliodonium hexafluoroantimonate SHANGHAI YURLIC CHEMICAL S&T CO LTD 2016-02-03 CN claimed
CN-105294408-B Cation light initiator(2 hydroxy-tetradecyl oxygen phenyl)The preparation method of benzene iodine hexafluoro antimonate 上海予利生物科技股份有限公司 2017-12-26 CN disclosed
CN-105294408-A Preparation method for cationic photoinitiator (2-hydroxytetradecyloxyphenyl) phenyliodonium hexafluoroantimonate SHANGHAI YURLIC CHEMICAL S&T CO LTD 2016-02-03 CN disclosed