SCHEMBL27557794

SCHEMBL27557794

CCCCCCCCC=C(CCCCCCCC)C(=O)OC(O)c1c(CO)cnc(C)c1O

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PDXK O00764 1/20 0.39
▸ KDM4E B2RXH2 4/20 0.36
▸ ALDH1A1 P00352 4/20 0.36
▸ LMNA P02545 4/20 0.36
▸ HPGD P15428 3/20 0.36
▸ MEN1 O00255 1/20 0.36
▸ KMT2A Q03164 1/20 0.36
▸ AOX1 Q06278 1/20 0.36
▸ TRIM24 O15164 1/20 0.36
▸ TRIM33 Q9UPN9 1/20 0.36
▸ HDAC1 Q13547 2/20 0.34
▸ HSD17B10 Q99714 1/20 0.34
▸ SGPL1 O95470 2/20 0.34
▸ TBXAS1 P24557 1/20 0.31
▸ FAAH O00519 3/20 0.31
▸ GFER P55789 1/20 0.31
▸ DGKA P23743 1/20 0.31
▸ HTT P42858 2/20 0.31
▸ SMN1; SMN2 Q16637 2/20 0.31
▸ L3MBTL1 Q9Y468 2/20 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
SCHEMBL27539162 0.83 PDXK (0.42) PDXKKDM4EALDH1A1LMNAHPGD
SCHEMBL27588200 0.83 PDXK (0.42) PDXKKDM4EALDH1A1LMNAHPGD
SCHEMBL27606029 0.83 PDXK (0.42) PDXKKDM4EALDH1A1LMNAHPGD
SCHEMBL28806636 0.77 KDM4E (0.44) PDXKKDM4EALDH1A1LMNAHPGD
SCHEMBL3065438 0.75 PDXK (0.45) PDXKKDM4EALDH1A1LMNAHPGD
SCHEMBL27550757 0.75 PDXK (0.40) PDXKKDM4EALDH1A1LMNAHPGD
SCHEMBL27339626 0.74 PDXK (0.48) PDXKKDM4EALDH1A1LMNAHPGD
SCHEMBL28031310 0.73 KDM4E (0.40) PDXKKDM4EALDH1A1LMNAHPGD
SCHEMBL27437788 0.73 KDM4E (0.47) PDXKKDM4EALDH1A1LMNAHPGD
SCHEMBL29076988 0.72 LMNA (0.45) LMNAMEN1KMT2AHSD17B10FAAH

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
CN-1385457-A Gel composition PANRICO PARTNERSHIP INC (US) 2002-12-18 — — CN disclosed
CN-1348815-A Medicine for preventing and treating coronary heart disease and angina pectoris and its prepn and other use TIANJIN TIANSHILI PHARMACEUTIC (CN) 2002-05-15 — — CN disclosed
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