SCHEMBL27643276

SCHEMBL27643276

CCCCCCCCCCCCc1ccccc1-c1cccc(S(=O)(=O)O)c1S(=O)(=O)OC

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 3/20 0.41
ELANE P08246 3/20 0.41
LIPG Q9Y5X9 1/20 0.40
NR1H2 P55055 1/20 0.40
NR1H3 Q13133 1/20 0.40
ALOX5 P09917 1/20 0.40
PTGS2 P35354 1/20 0.40
CTSG P08311 1/20 0.39
BID P55957 3/20 0.39
MCL1 Q07820 3/20 0.39
BCL2L1 Q07817 2/20 0.39
BAK1 Q16611 2/20 0.39
KAT8 Q9H7Z6 2/20 0.39
PPARG P37231 2/20 0.39
EP300 Q09472 1/20 0.39
KAT2A Q92830 1/20 0.39
KAT2B Q92831 1/20 0.39
KAT5 Q92993 1/20 0.39
SAE1 Q9UBE0 1/20 0.39
THRA P10827 1/20 0.38

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
SCHEMBL27643264 0.93 NR1H2 (0.42) PPARAELANELIPGNR1H2NR1H3
SCHEMBL1594278 0.89 LIPG (0.45) PPARAELANELIPGNR1H2NR1H3
SCHEMBL28054822 0.89 LIPG (0.45) PPARAELANELIPGNR1H2NR1H3
Ammonia Solution, Strong SCHEMBL27898384 0.87 LIPG (0.44) PPARAELANELIPGNR1H2NR1H3
SCHEMBL6860460 0.84 LIPG (0.49) PPARAELANELIPGNR1H2NR1H3
SCHEMBL2209708 0.84 LIPG (0.49) PPARAELANELIPGNR1H2NR1H3
SCHEMBL28988406 0.83 LIPG (0.47) PPARAELANELIPGNR1H2NR1H3
SCHEMBL285068 0.80 LIPG (0.53) PPARALIPGNR1H2NR1H3BID
SCHEMBL31026103 0.80 LIPG (0.53) PPARALIPGNR1H2NR1H3BID
SCHEMBL339908 0.79 BID (0.48) PPARAELANELIPGALOX5PTGS2

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
CN-100354258-C Bialkylbiphenyl sodium disulfonate, and its preparing method XIHUA NORMAL UNIV (CN) 2007-12-12 CN disclosed
CN-1850795-A Bialkylbiphenyl sodium disulfonate, and its preparing method XIHUA NORMAL UNIV (CN) 2006-10-25 CN disclosed