SCHEMBL8022507

SCHEMBL8022507

CCCCc1cccc(O)c1CCCCOc1ccccc1

nearest known ligand 0.49

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 2/20 0.49
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 1/20 0.46
PPARA Q07869 1/20 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
LTB4R Q15722 1/20 0.44
LTB4R2 Q9NPC1 1/20 0.44
KCNA3 P22001 1/20 0.44

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
SCHEMBL31121838 0.96 LTA4H (0.51) LTA4HBIDMCL1BCL2L1BAK1
Phenol SCHEMBL11309882 0.90 NR5A1 (0.50) LTA4HBIDMCL1BCL2L1BAK1
Methoxymethane SCHEMBL28088272 0.83 PTGS2 (0.51) BIDMCL1BCL2L1BAK1KAT8
SCHEMBL983356 0.83 BID (0.57) BIDMCL1BCL2L1BAK1KAT8
SCHEMBL162389 0.83 BID (0.51) BIDMCL1BCL2L1BAK1KAT8
SCHEMBL30468817 0.83 BID (0.51) BIDMCL1BCL2L1BAK1KAT8
SCHEMBL984149 0.82 BID (0.59) BIDMCL1BCL2L1BAK1KAT8
SCHEMBL984067 0.82 BID (0.59) BIDMCL1BCL2L1BAK1KAT8
SCHEMBL97903 0.82 BID (0.59) BIDMCL1BCL2L1BAK1KAT8
SCHEMBL983867 0.82 BID (0.59) BIDMCL1BCL2L1BAK1KAT8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6143905-A REACTING 1,7-DIBROMOPERYLENE-3,4,9,10-TETRACARBOXYLIC DIANHYDRIDE OR TETRACARBOXYLIC ACID IN PRESENCE OF APROTIC SOLVENT WITH A PRIMARY AMINE TO FORM DIIMIDE, REACTING DIIMIDE WITH AROMATIC ALOCHOL OR THIOL, AND HYDROLYZING BASF AKTIENGESELLSCHAFT (DE) 2000-11-07 US disclosed