SCHEMBL2785822

SCHEMBL2785822

CC(O)Cc1oc(=O)c2ccccc2c1-c1ccc(OCC2CC2)c(OCC(N)=O)c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PDE4B Q07343 6/20 0.41
▸ PDE4A P27815 4/20 0.41
▸ PDE4C Q08493 4/20 0.41
▸ PDE4D Q08499 4/20 0.41
▸ PDE7A Q13946 1/20 0.41
▸ MEN1 O00255 4/20 0.36
▸ KMT2A Q03164 4/20 0.36
▸ PSMD14 O00487 1/20 0.36
▸ MMP2 P08253 1/20 0.36
▸ BLM P54132 1/20 0.36
▸ ALDH1A1 P00352 3/20 0.36
▸ CYP3A4 P08684 1/20 0.36
▸ CYP2C9 P11712 1/20 0.36
▸ CYP2C19 P33261 1/20 0.36
▸ GAA P10253 1/20 0.35
▸ SMN1; SMN2 Q16637 1/20 0.35
▸ FPR2 P25090 1/20 0.34
▸ KDM4E B2RXH2 1/20 0.34
▸ MAOA P21397 1/20 0.33
▸ MAOB P27338 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
SCHEMBL2769824 0.89 PDE4D (0.51) PDE4BPDE4APDE4CPDE4DPDE7A
SCHEMBL2773020 0.88 KMT2A (0.43) MEN1KMT2APSMD14MMP2BLM
SCHEMBL2791143 0.88 DHODH (0.42) PDE4BPDE4APDE4CPDE4DPDE7A
SCHEMBL2772268 0.87 KMT2A (0.44) PDE4BPDE4APDE4CPDE4DPDE7A
SCHEMBL2786982 0.87 PDE4D (0.41) PDE4BPDE4APDE4CPDE4DPDE7A
SCHEMBL2787889 0.86 PDE4A (0.38) PDE4BPDE4APDE4CPDE4DPDE7A
SCHEMBL2787871 0.86 PDE4D (0.40) PDE4BPDE4APDE4CPDE4DPDE7A
SCHEMBL2785816 0.82 PDE4B (0.60) PDE4BPDE4APDE4CPDE4DPDE7A
SCHEMBL2788405 0.80 PDE4A (0.51) PDE4BPDE4APDE4CPDE4DPDE7A
SCHEMBL2772806 0.78 KDM4E (0.48) PDE4BPDE4APDE4CPDE4DMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2010076564-A2 ISOCHROMENONES USEFUL IN THE TREATMENT OF INFLAMMATION BIOLIPOX AB (SE) 2010-07-08 — — WO disclosed
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