SCHEMBL8566183

SCHEMBL8566183

CCCCCCCCc1ccc[c]c1-c1ccccc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LIPG Q9Y5X9 1/20 0.47
BID P55957 3/20 0.41
MCL1 Q07820 3/20 0.41
BCL2L1 Q07817 2/20 0.41
BAK1 Q16611 2/20 0.41
KAT8 Q9H7Z6 2/20 0.41
PPARA Q07869 2/20 0.41
PPARG P37231 1/20 0.41
EP300 Q09472 1/20 0.41
KAT2A Q92830 1/20 0.41
KAT2B Q92831 1/20 0.41
KAT5 Q92993 1/20 0.41
SAE1 Q9UBE0 1/20 0.41
NR1H2 P55055 1/20 0.40
NR1H3 Q13133 1/20 0.40
CYSLTR2 Q9NS75 4/20 0.40
CYSLTR1 Q9Y271 4/20 0.40
MEN1 O00255 1/20 0.39
TP53 P04637 1/20 0.39
CYP3A4 P08684 1/20 0.39

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
SCHEMBL983505 1.00 LIPG (0.47) LIPGBIDMCL1BCL2L1BAK1
SCHEMBL17802345 1.00 LIPG (0.47) LIPGBIDMCL1BCL2L1BAK1
SCHEMBL981932 0.98 LIPG (0.45) LIPGBIDMCL1BCL2L1BAK1
SCHEMBL982519 0.93 LIPG (0.39) LIPGBIDMCL1BCL2L1BAK1
SCHEMBL983255 0.86 SREBF2 (0.33) LIPGPPARAPPARGMAPT
SCHEMBL12815176 0.79 LIPG (0.46) LIPGBIDMCL1BCL2L1BAK1
SCHEMBL5271436 0.79 LIPG (0.46) LIPGBIDMCL1BCL2L1BAK1
SCHEMBL8519841 0.79 LIPG (0.46) LIPGBIDMCL1BCL2L1BAK1
SCHEMBL982140 0.79 GABRA1 (0.35) TP53MAPTKMT2A
SCHEMBL9400761 0.78 LIPG (0.47) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0821675-A1 NOVEL HYDROXAMIC ACID AND AMINO-CARBOXYLATE COMPOUNDS AS METALLOPROTEASE AND TNF INHIBITORS THE DU PONT MERCK PHARMACEUTICAL COMPANY (US) 1998-02-04 EP disclosed
WO-1996033176-A1 NOVEL HYDROXAMIC ACID AND AMINO-CARBOXYLATE COMPOUNDS AS METALLOPROTEASE AND TNF INHIBITORS THE DU PONT MERCK PHARMACEUTICAL COMPANY (US) 1996-10-24 WO disclosed