SCHEMBL13680792

SCHEMBL13680792

NC(=O)Oc1ccc(-c2cccc(CCC=O)c2)cc1

nearest known ligand 0.46

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
ABHD6 Q9BV23 2/20 0.42
KIF11 P52732 1/20 0.42
FFAR1 O14842 3/20 0.40
AKR1B1 P15121 1/20 0.40
FFAR4 Q5NUL3 1/20 0.40
GPR52 Q9Y2T5 1/20 0.39
LMNA P02545 1/20 0.39
GAA P10253 1/20 0.39
BCL2 P10415 1/20 0.38
F2 P00734 1/20 0.37
ACMSD Q8TDX5 1/20 0.37
ASAH1 Q13510 1/20 0.37
MAPT P10636 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
NR4A2 P43354 1/20 0.36
AOC3 Q16853 1/20 0.36

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
SCHEMBL13681368 0.87 AOC3 (0.40) ABHD6FFAR1AKR1B1FFAR4GPR52
SCHEMBL13680791 0.86 GAA (0.55) MEN1KMT2AABHD6FFAR1AKR1B1
SCHEMBL3830344 0.84 KMT2A (0.58) MEN1KMT2A
SCHEMBL13680799 0.83 ACHE (0.52) KMT2AABHD6FFAR1LMNA
SCHEMBL13680793 0.83 BCHE (0.47) ABHD6FFAR1LMNAGAAMAPT
SCHEMBL13680794 0.82 AOC3 (0.53) ABHD6GPR52BCL2AOC3
SCHEMBL13680783 0.81 FFAR1 (0.45) FFAR1AKR1B1FFAR4GPR52F2
SCHEMBL13680784 0.80 ABL1 (0.50) FFAR1GPR52LMNA
SCHEMBL2302446 0.79 FFAR4 (0.46) FFAR1AKR1B1FFAR4GPR52NR4A2
SCHEMBL13680800 0.78 KIF11 (0.52) KIF11FFAR1FFAR4GPR52GAA

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
US-7582658-B2 Bicyclic compound ASAHI KASEI PHARMA CORPORATION (JP) 2009-09-01 US disclosed
US-7582658-B2 Bicyclic compound ASAHI KASEI PHARMA CORPORATION (JP) 2009-09-01 US disclosed