SCHEMBL7260904

SCHEMBL7260904

O=C(O)CCCCn1cccc(O)c1=O

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EGLN1 Q9GZT9 2/20 0.46
VEGFA P15692 1/20 0.46
PARP1 P09874 1/20 0.44
FABP4 P15090 2/20 0.44
FABP5 Q01469 2/20 0.44
PTGS1 P23219 4/20 0.44
PTGS2 P35354 4/20 0.44
MMP2 P08253 1/20 0.41
MMP9 P14780 1/20 0.41
IL1RN P18510 2/20 0.41
ERAP2 Q6P179 2/20 0.41
ERAP1 Q9NZ08 2/20 0.41
KAT2A Q92830 1/20 0.39
KAT2B Q92831 1/20 0.39
MAPT P10636 2/20 0.39
RXFP1 Q9HBX9 1/20 0.39
HDAC3 O15379 1/20 0.39
HDAC4 P56524 1/20 0.39
HDAC1 Q13547 1/20 0.39
HDAC7 Q8WUI4 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
SCHEMBL7256476 0.95 EGLN1 (0.47) EGLN1VEGFAPARP1FABP4FABP5
SCHEMBL7256310 0.88 PARP1 (0.55) EGLN1VEGFAPARP1FABP4FABP5
SCHEMBL16088173 0.80 ALDH1A1 (0.49) EGLN1VEGFAMMP2MMP9MAPT
SCHEMBL7256324 0.79 TNF (0.46) PARP1FABP4FABP5PTGS1PTGS2
SCHEMBL27636352 0.79 ALDH1A1 (0.48) EGLN1VEGFAPTGS1PTGS2MMP2
SCHEMBL31041845 0.79 ALDH1A1 (0.48) EGLN1VEGFAPTGS1PTGS2MMP2
SCHEMBL13962027 0.78 EGLN1 (0.50) EGLN1VEGFAPARP1MMP2MMP9
SCHEMBL9453852 0.78 ALDH1A1 (0.54) EGLN1VEGFAMMP2MMP9
SCHEMBL5179205 0.78 EGLN1 (0.53) EGLN1VEGFAMMP2MMP9IL1RN
SCHEMBL14221996 0.77 PARP1 (0.44) PARP1FABP4FABP5KAT2AKAT2B

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
WO-2003103668-A1 PYRIDIN-2-ONE AND QUINOLIN-2-ONE DERIVATIVES, PREPARATION THEREOF AND USE THEREOF AS ANTIBACTERIALS KARO BIO AB (SE) 2003-12-18 WO claimed
WO-2003103668-A1 PYRIDIN-2-ONE AND QUINOLIN-2-ONE DERIVATIVES, PREPARATION THEREOF AND USE THEREOF AS ANTIBACTERIALS KARO BIO AB (SE) 2003-12-18 WO disclosed