SCHEMBL28035920

SCHEMBL28035920

COc1cc(C(=O)OC(=O)/C=C/c2ccc(O)c(O)c2)ccc1OC(=O)/C=C/c1ccc(O)c(O)c1

nearest known ligand 0.65

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ MAOA P21397 1/20 0.63
▸ MAOB P27338 1/20 0.63
▸ PDE4A P27815 2/20 0.58
▸ PDE4B Q07343 2/20 0.58
▸ PDE4C Q08493 2/20 0.58
▸ PDE4D Q08499 2/20 0.58
▸ EPHX2 P34913 3/20 0.56
▸ APP P05067 2/20 0.54
▸ TTR P02766 1/20 0.54
▸ PTPN1 P18031 1/20 0.52
▸ EGFR P00533 1/20 0.52
▸ CSK P41240 1/20 0.52
▸ ABCG2 Q9UNQ0 1/20 0.51
▸ MMP1 P03956 1/20 0.50

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
SCHEMBL2791904 0.92 MAOA (0.64) MAOAMAOBPDE4APDE4BPDE4C
SCHEMBL2791897 0.92 MAOA (0.64) MAOAMAOBPDE4APDE4BPDE4C
SCHEMBL13231167 0.84 APP (0.74) MAOAMAOBPDE4APDE4BPDE4C
SCHEMBL289638 0.83 KDM4E (0.68) MAOAMAOBPDE4APDE4BPDE4C
SCHEMBL13231197 0.83 MAOB (0.68) MAOAMAOBPDE4APDE4BPDE4C
SCHEMBL7067602 0.83 MAOB (0.68) MAOAMAOBPDE4APDE4BPDE4C
SCHEMBL2792887 0.83 MAOB (0.68) MAOAMAOBPDE4APDE4BPDE4C
Caffeic Acid SCHEMBL27796518 0.82 CA12 (0.60) MAOAMAOBEPHX2APPTTR
SCHEMBL1236960 0.81 MAOA (0.65) MAOAMAOBPDE4APDE4BPDE4C
SCHEMBL19031712 0.81 CXCL12 (0.67) MAOBPDE4APDE4BPDE4CPDE4D

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
CN-105343701-A Thrombolysis powder capable of invigorating circulation of blood for treating vasculitis and preparation method of thrombolysis powder HUANG JIANMIN 2016-02-24 — — CN disclosed
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