SCHEMBL8807943

SCHEMBL8807943

CCCCCc1cc2c(nc1C=O)C(=O)C=CC2=O

nearest known ligand 0.36

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ACHE P22303 1/20 0.36
BACE1 P56817 1/20 0.36
S100A4 P26447 1/20 0.35
HCAR2 Q8TDS4 2/20 0.33
GPR84 Q9NQS5 11/20 0.33
TLR8 Q9NR97 1/20 0.32
NR1H2 P55055 1/20 0.31
NR1H3 Q13133 1/20 0.31
HIF1A Q16665 1/20 0.31
EPAS1 Q99814 1/20 0.31
FAAH O00519 1/20 0.31
MGLL Q99685 1/20 0.31

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
SCHEMBL3554775 0.77 PPARA (0.39) ACHEBACE1HCAR2GPR84
SCHEMBL23271870 0.70 ACHE (0.41) ACHEBACE1HCAR2GPR84NR1H2
SCHEMBL27947021 0.65 TLR8 (0.61) ACHETLR8
SCHEMBL6261189 0.64 HIF1A (0.40) HCAR2GPR84HIF1AEPAS1
SCHEMBL28357045 0.63 ELANE (0.43) ACHEBACE1S100A4NR1H2NR1H3
SCHEMBL28345511 0.63 ELANE (0.43) ACHEBACE1S100A4NR1H2NR1H3
SCHEMBL28429565 0.62 HIF1A (0.44) GPR84HIF1AEPAS1
SCHEMBL28428038 0.62 HIF1A (0.44) GPR84HIF1AEPAS1
SCHEMBL7088782 0.62 HIF1A (0.44) GPR84HIF1AEPAS1
SCHEMBL29211013 0.62 HIF1A (0.41) GPR84HIF1AEPAS1

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-0701557-A4 LAVENDAMYCIN ANALOGS, THEIR USE AND PREPARATION BEHFOROUZ MOHAMMAD (US) 1997-07-09 EP disclosed
EP-0701557-A1 LAVENDAMYCIN ANALOGS, THEIR USE AND PREPARATION BEHFOROUZ, Mohammad (US) 1996-03-20 EP disclosed