SCHEMBL2578436

SCHEMBL2578436

CCCCCCCCc1ccccc1[C](C)C

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LIPG Q9Y5X9 1/20 0.59
BID P55957 3/20 0.46
MCL1 Q07820 3/20 0.46
BCL2L1 Q07817 2/20 0.46
BAK1 Q16611 2/20 0.46
KAT8 Q9H7Z6 2/20 0.46
PPARG P37231 2/20 0.46
PPARA Q07869 2/20 0.46
EP300 Q09472 1/20 0.46
KAT2A Q92830 1/20 0.46
KAT2B Q92831 1/20 0.46
KAT5 Q92993 1/20 0.46
SAE1 Q9UBE0 1/20 0.46
KCNH2 Q12809 1/20 0.46
THRA P10827 1/20 0.45
THRB P10828 1/20 0.45
NR1H2 P55055 1/20 0.45
NR1H3 Q13133 1/20 0.45
ALOX5 P09917 2/20 0.45
PTGS2 P35354 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
SCHEMBL11882207 1.00 LIPG (0.59) LIPGBIDMCL1BCL2L1BAK1
SCHEMBL233336 1.00 LIPG (0.59) LIPGBIDMCL1BCL2L1BAK1
SCHEMBL233504 1.00 LIPG (0.59) LIPGBIDMCL1BCL2L1BAK1
SCHEMBL727790 1.00 LIPG (0.59) LIPGBIDMCL1BCL2L1BAK1
SCHEMBL3134436 1.00 LIPG (0.59) LIPGBIDMCL1BCL2L1BAK1
SCHEMBL5597104 0.92 LIPG (0.48) LIPGBIDMCL1BCL2L1BAK1
SCHEMBL11322793 0.90 F7 (0.53) LIPGBIDMCL1BCL2L1BAK1
SCHEMBL1040033 0.89 LIPG (0.59) LIPGBIDMCL1BCL2L1BAK1
SCHEMBL8492034 0.89 LIPG (0.59) LIPGBIDMCL1BCL2L1BAK1
SCHEMBL11747899 0.87 F7 (0.55) LIPGBIDMCL1BCL2L1BAK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8048841-B2 Spray-type bleaching agent KAO CORPORATION (JP) 2011-11-01 US disclosed
US-20100193735-A1 SPRAY-TYPE BLEACHING AGENT KAO CORPORATION (JP) 2010-08-05 US disclosed
US-20090226616-A1 FOUNTAIN SOLUTION COMPOSITION FOR LITHOGRAPHIC PRINTING AND HEAT-SET OFFSET ROTARY PRINTING PROCESS FUJIFILM CORPORATION (JP) 2009-09-10 US disclosed