SCHEMBL19986675

SCHEMBL19986675

CCc1c(C)cncc1Cl

nearest known ligand 0.34

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
BDKRB2 P30411 1/20 0.34
NOS3 P29474 1/20 0.32
NOS2 P35228 1/20 0.32
PDE4D Q08499 4/20 0.32
PDE4A P27815 1/20 0.31
PDE4B Q07343 1/20 0.31
PDE4C Q08493 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
SCHEMBL10079575 0.85 PDE4D (0.35) BDKRB2PDE4DPDE4APDE4BPDE4C
SCHEMBL11154608 0.83 NOS3 (0.38) NOS3NOS2
SCHEMBL13059148 0.80 KDM4E (0.34) BDKRB2PDE4DPDE4A
SCHEMBL13059147 0.80 BDKRB2 (0.33) BDKRB2PDE4D
SCHEMBL21736851 0.77 PDE4D (0.35) BDKRB2PDE4DPDE4APDE4BPDE4C
SCHEMBL24594992 0.76 PDE4D (0.31) BDKRB2PDE4DPDE4APDE4BPDE4C
SCHEMBL28833560 0.76 GAA (0.40) BDKRB2NOS3NOS2PDE4DPDE4A
SCHEMBL21736891 0.76 CYP11B2 (0.40) BDKRB2PDE4DPDE4APDE4BPDE4C
SCHEMBL31445768 0.75 MAPT (0.31) BDKRB2
SCHEMBL17681786 0.75 IMPDH2 (0.33) BDKRB2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3611165-B1 PYRIDONE COMPOUND, AND AGRICULTURAL AND HORTICULTURAL FUNGICIDE HAVING THIS AS ACTIVE COMPONENT MITSUI CHEMICALS CROP & LIFE SOLUTIONS INC (JP) 2023-08-16 EP disclosed
EP-3636636-B1 PYRIDONE COMPOUND AND AGRICULTURAL AND HORTICULTURAL FUNGICIDE MITSUI CHEMICALS AGRO INC (JP) 2022-07-06 EP disclosed
EP-3611165-A1 PYRIDONE COMPOUND, AND AGRICULTURAL AND HORTICULTURAL FUNGICIDE HAVING THIS AS ACTIVE COMPONENT Mitsui Chemicals Agro, Inc. (JP) 2020-02-19 EP disclosed
EP-2432776-B1 METHYL SULFANYL PYRIMIDINES USEFUL AS ANTIINFLAMMATORIES, ANALGESICS, AND ANTIEPILEPTICS UNIV LAVAL (CA) 2019-09-11 EP disclosed
WO-2018050110-A1 NOVEL CAPSID PROTEIN ASSEMBLY INHIBITOR 正大天晴药业集团股份有限公司 2018-03-22 WO disclosed