SCHEMBL11476337

SCHEMBL11476337

CCCCCc1cccc2c([C]=O)cccc12

nearest known ligand 0.42

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
BID P55957 3/20 0.42
MCL1 Q07820 3/20 0.42
BCL2L1 Q07817 2/20 0.42
BAK1 Q16611 2/20 0.42
KAT8 Q9H7Z6 2/20 0.42
PPARA Q07869 2/20 0.42
PPARG P37231 1/20 0.42
EP300 Q09472 1/20 0.42
KAT2A Q92830 1/20 0.42
KAT2B Q92831 1/20 0.42
KAT5 Q92993 1/20 0.42
SAE1 Q9UBE0 1/20 0.42
LIPG Q9Y5X9 1/20 0.41
KCNH2 Q12809 1/20 0.41
ALOX5 P09917 1/20 0.41
PTGS2 P35354 1/20 0.41
TLR8 Q9NR97 5/20 0.40
NR1H2 P55055 1/20 0.38
NR1H3 Q13133 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
SCHEMBL1584216 0.82 LIPG (0.50) BIDMCL1BCL2L1BAK1KAT8
SCHEMBL9670621 0.82 GABRA1 (0.44)
SCHEMBL1644574 0.81 BID (0.43) BIDMCL1BCL2L1BAK1KAT8
SCHEMBL2121348 0.81 LIPG (0.53) BIDMCL1BCL2L1BAK1KAT8
SCHEMBL10473131 0.81 LIPG (0.53) BIDMCL1BCL2L1BAK1KAT8
SCHEMBL2119800 0.81 LIPG (0.53) BIDMCL1BCL2L1BAK1KAT8
SCHEMBL10708843 0.81 LIPG (0.53) BIDMCL1BCL2L1BAK1KAT8
SCHEMBL6222240 0.81 LIPG (0.53) BIDMCL1BCL2L1BAK1KAT8
SCHEMBL3302964 0.80 BID (0.45) BIDMCL1BCL2L1BAK1KAT8
SCHEMBL19465419 0.78 LIPG (0.45) 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-4187230-A Preparation of 5-aroyl-pyrrole compounds ETHYL CORPORATION (US) 1980-02-05 US disclosed