SCHEMBL29935906

SCHEMBL29935906

COc1cc(OC)c(Cl)c(-c2cn(C)c(=O)c(C)c2-c2ccc(F)cc2Cl)c1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 3/20 0.39
BRD4 O60885 6/20 0.37
BRD2 P25440 2/20 0.36
BRD9 Q9H8M2 2/20 0.36
BRD7 Q9NPI1 2/20 0.36
ELANE P08246 1/20 0.35
EGFR P00533 1/20 0.34
ALDH1A1 P00352 2/20 0.33
CYP1A2 P05177 1/20 0.33
CYP3A4 P08684 1/20 0.33
HSD11B1 P28845 1/20 0.33
P2RX7 Q99572 1/20 0.33
NPBWR1 P48145 1/20 0.33
MCHR1 Q99705 1/20 0.33
KDM4E B2RXH2 1/20 0.33
MEN1 O00255 1/20 0.33
LMNA P02545 1/20 0.33
GLA P06280 1/20 0.33
GAA P10253 1/20 0.33
MAPT P10636 1/20 0.33

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
SCHEMBL29936083 0.92 MAPK14 (0.40) MAPK14BRD4BRD2ELANEEGFR
SCHEMBL27094647 0.86 PDE2A (0.40) MAPK14BRD4BRD2HSD11B1P2RX7
SCHEMBL29936000 0.83 MAPK14 (0.39) MAPK14BRD4ELANEEGFRALDH1A1
SCHEMBL27093267 0.82 MAPK14 (0.39) MAPK14ELANEEGFRALDH1A1CYP1A2
SCHEMBL27093112 0.82 MAPK14 (0.39) MAPK14ELANEEGFRALDH1A1CYP1A2
SCHEMBL23755075 0.82 MAPK14 (0.38) MAPK14BRD4ELANEEGFRHSD11B1
SCHEMBL29872502 0.82 MAPK14 (0.38) MAPK14BRD4ELANEEGFRHSD11B1
SCHEMBL27093113 0.79 MAPK14 (0.37) MAPK14ELANEEGFRALDH1A1CYP1A2
SCHEMBL27093101 0.79 PDE2A (0.39) MAPK14BRD4BRD2P2RX7
SCHEMBL29936244 0.78 MAPK14 (0.39) MAPK14BRD4BRD2HSD11B1P2RX7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4323342-A1 FUNGICIDAL PYRIDONES FMC CORPORATION (US) 2024-02-21 EP claimed
CN-117203188-A Fungicidal pyridones FMC公司 2023-12-08 CN claimed
WO-2022221165-A1 FUNGICIDAL PYRIDONES FMC CORPORATION (US) 2022-10-20 WO claimed
EP-4323342-A1 FUNGICIDAL PYRIDONES FMC CORPORATION (US) 2024-02-21 EP disclosed
CN-117203188-A Fungicidal pyridones FMC公司 2023-12-08 CN disclosed
WO-2022221165-A1 FUNGICIDAL PYRIDONES FMC CORPORATION (US) 2022-10-20 WO disclosed