SCHEMBL13617003

SCHEMBL13617003

Cc1ccccc1CCn1cccc(O)c1=O

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 3/20 0.46
MMP9 P14780 3/20 0.46
EGLN1 Q9GZT9 2/20 0.44
VEGFA P15692 1/20 0.44
DAO P14920 2/20 0.43
GPR84 Q9NQS5 1/20 0.43
POLB P06746 1/20 0.41
ERAP2 Q6P179 2/20 0.40
IL1RN P18510 1/20 0.40
ERAP1 Q9NZ08 1/20 0.40
TAAR1 Q96RJ0 1/20 0.40
HDAC3 O15379 1/20 0.39
HDAC4 P56524 1/20 0.39
HDAC1 Q13547 1/20 0.39
HDAC7 Q8WUI4 1/20 0.39
HDAC2 Q92769 1/20 0.39
HDAC10 Q969S8 1/20 0.39
HDAC11 Q96DB2 1/20 0.39
HDAC8 Q9BY41 1/20 0.39
HDAC6 Q9UBN7 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
SCHEMBL217112 0.82 HDAC3 (0.50) MMP2MMP9EGLN1VEGFADAO
SCHEMBL13616980 0.82 EGLN1 (0.44) MMP2MMP9EGLN1VEGFADAO
SCHEMBL9453861 0.75 EGLN1 (0.53) MMP2MMP9EGLN1VEGFAERAP2
SCHEMBL29299526 0.75 EGLN1 (0.47) MMP2MMP9EGLN1VEGFA
SCHEMBL13019449 0.73 HDAC3 (0.72) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL9453852 0.72 ALDH1A1 (0.54) MMP2MMP9EGLN1VEGFALMNA
SCHEMBL16088173 0.71 ALDH1A1 (0.49) MMP2MMP9EGLN1VEGFAMAPT
SCHEMBL20382954 0.71 EGLN1 (0.49) MMP2MMP9EGLN1VEGFAERAP2
SCHEMBL10301534 0.71 EGLN1 (0.49) MMP2MMP9EGLN1VEGFAERAP2
SCHEMBL2645984 0.71 EGLN1 (0.56) MMP2MMP9EGLN1VEGFAERAP2

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2729449-A1 5- OR 6 - SUBSTITUTED 3 - HYDROXY - 2 ( 1H) - PYRIDINONES AS D-AMINO ACID OXIDASE (DAAO) INHIBITORS IN THERAPY OF DISEASES SUCH AS SCHIZOPHRENIA, COGNITIVE DISORDER AND PAIN Takeda Pharmaceutical Company Limited (JP) 2014-05-14 EP disclosed
WO-2013004996-A1 5- OR 6 - SUBSTITUTED 3 - HYDROXY - 2 ( 1H) - PYRIDINONES AS D-AMINO ACID OXIDASE (DAAO) INHIBITORS IN THERAPY OF DISEASES SUCH AS SCHIZOPHRENIA, COGNITIVE DISORDER AND PAIN TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2013-01-10 WO disclosed
EP-1477186-B1 ANTIPRURITICS SHIONOGI & CO (JP) 2009-11-11 EP disclosed