SCHEMBL27434370

SCHEMBL27434370

CCCCCCCCCCCCCCC(C)c1c(O)cccc1CCCC

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BID P55957 5/20 0.49
MCL1 Q07820 5/20 0.49
BCL2L1 Q07817 4/20 0.49
BAK1 Q16611 4/20 0.49
KAT8 Q9H7Z6 3/20 0.49
SAE1 Q9UBE0 2/20 0.49
EP300 Q09472 2/20 0.49
KAT5 Q92993 2/20 0.49
PPARG P37231 1/20 0.49
PPARA Q07869 1/20 0.49
KAT2A Q92830 1/20 0.49
KAT2B Q92831 1/20 0.49
F7 P08709 3/20 0.43
F3 P13726 3/20 0.43
MMP2 P08253 2/20 0.43
MAPT P10636 2/20 0.43
ALOX15 P16050 2/20 0.43
KDM4E B2RXH2 1/20 0.43
ECE1 P42892 1/20 0.43
SGMS1 Q86VZ5 1/20 0.43

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
SCHEMBL29209369 0.94 BID (0.44) BIDMCL1BCL2L1BAK1KAT8
SCHEMBL9281627 0.87 ALDH1A1 (0.46) BIDMCL1BCL2L1BAK1KAT8
SCHEMBL31545167 0.87 ALDH1A1 (0.46) BIDMCL1BCL2L1BAK1KAT8
SCHEMBL31545285 0.87 ALDH1A1 (0.46) BIDMCL1BCL2L1BAK1KAT8
SCHEMBL4594765 0.83 BID (0.57) BIDMCL1BCL2L1BAK1KAT8
SCHEMBL28809978 0.83 BID (0.54) BIDMCL1BCL2L1BAK1KAT8
SCHEMBL4595968 0.83 BID (0.57) BIDMCL1BCL2L1BAK1KAT8
SCHEMBL4595387 0.83 BID (0.57) BIDMCL1BCL2L1BAK1KAT8
SCHEMBL28808847 0.83 BID (0.54) BIDMCL1BCL2L1BAK1KAT8
SCHEMBL28046235 0.83 BID (0.54) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1125072-C Dibenzonaphathyrones, method for the production thereof and use thereof for dyeing/coloring CIBA SC HOLDING AG (CH) 2003-10-22 CN disclosed
CN-1296487-A Tribenzodioxynaphthalenediones and their use for dyeing/pigmenting high molecular weight organic materials CIBA SC HOLDING AG (CH) 2001-05-23 CN disclosed