SCHEMBL14722803

SCHEMBL14722803

O=c1[nH]ncc(CCc2ccc(Cl)cc2)c1O

nearest known ligand 0.47

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
DAO P14920 7/20 0.47
PKM P14618 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
CYP1A2 P05177 1/20 0.38
CYP2D6 P10635 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
ROCK2 O75116 1/20 0.38
ROCK1 Q13464 1/20 0.38
GPR84 Q9NQS5 1/20 0.37
ALDH1A1 P00352 1/20 0.37
AKR1B1 P15121 1/20 0.36
POLB P06746 1/20 0.36
KMT2A Q03164 1/20 0.36
LMNA P02545 1/20 0.35

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
SCHEMBL14723616 0.86 LMNA (0.42) DAOSMN1; SMN2L3MBTL1KMT2ALMNA
SCHEMBL14722466 0.81 DAO (0.46) DAOPOLBKMT2A
SCHEMBL14722416 0.78 DAO (0.48) DAOSMN1; SMN2GPR84ALDH1A1KMT2A
SCHEMBL14722542 0.73 DAO (0.49) DAOALDH1A1AKR1B1KMT2ALMNA
SCHEMBL10507388 0.72 ALDH1A1 (0.46) DAOPKMSMN1; SMN2ROCK2ROCK1
SCHEMBL14722008 0.72 DAO (0.42) DAOSMN1; SMN2ROCK2ROCK1ALDH1A1
SCHEMBL14721093 0.71 MAPT (0.43) DAOSMN1; SMN2GPR84ALDH1A1LMNA
SCHEMBL14723525 0.71 DAO (0.49) DAO
SCHEMBL14722889 0.70 RNASEH1 (0.43) DAOPKMCYP1A2L3MBTL1ALDH1A1
SCHEMBL2322736 0.67

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-2748149-A1 PYRIDAZINONE COMPOUNDS AND THEIR USE AS DAAO INHIBITORS Takeda Pharmaceutical Company Limited (JP) 2014-07-02 EP disclosed
WO-2013027000-A1 PYRIDAZINONE COMPOUNDS AND THEIR USE AS DAAO INHIBITORS TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2013-02-28 WO disclosed