SCHEMBL321597

SCHEMBL321597

CC(=O)CC(=O)CC(=O)O.CC(=O)CC(=O)CC(=O)O

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EGLN1 Q9GZT9 3/20 0.62
KDM4E B2RXH2 2/20 0.62
KDM5C P41229 2/20 0.62
PHF8 Q9UPP1 2/20 0.62
KDM2A Q9Y2K7 2/20 0.62
KDM6B O15054 1/20 0.62
LDHA P00338 1/20 0.47
SRR Q9GZT4 1/20 0.47
LMNA P02545 2/20 0.43
SLC15A2 Q16348 1/20 0.43
MGAM O43451 1/20 0.41
GAA P10253 1/20 0.41
SI P14410 1/20 0.41
MGAM2 Q2M2H8 1/20 0.41
HTT P42858 1/20 0.38
FFAR3 O14843 3/20 0.37
ALDH1A1 P00352 2/20 0.37
GLRA1 P23415 1/20 0.37
SLC6A9 P48067 1/20 0.37
OR51E2 Q9H255 1/20 0.37

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
SCHEMBL28887 1.00 EGLN1 (0.62) EGLN1KDM4EKDM5CPHF8KDM2A
SCHEMBL1774230 0.97 EGLN1 (0.59) EGLN1KDM4EKDM5CPHF8KDM2A
SCHEMBL28977856 0.97 EGLN1 (0.59) EGLN1KDM4EKDM5CPHF8KDM2A
SCHEMBL28832780 0.97 EGLN1 (0.59) EGLN1KDM4EKDM5CPHF8KDM2A
SCHEMBL28289355 0.92 PHF8 (0.54) EGLN1KDM4EKDM5CPHF8KDM2A
SCHEMBL28078303 0.87 KDM4E (0.50) EGLN1KDM4EKDM5CPHF8KDM2A
SCHEMBL235434 0.87 KDM4E (0.58) EGLN1KDM4EKDM5CPHF8KDM2A
SCHEMBL3519320 0.83 KDM4E (0.55) EGLN1KDM4EKDM5CPHF8KDM2A
SCHEMBL28706026 0.83 KDM4E (0.55) EGLN1KDM4EKDM5CPHF8KDM2A
SCHEMBL10936077 0.83 KDM4E (0.55) EGLN1KDM4EKDM5CPHF8KDM2A

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
US-20110183391-A1 Biosynthesis of Phloroglucinol and Preparation of 1,3-Dihydroxybenzene Therefrom BOARD OF TRUSTEES OF MICHIGAN STATE OF UNIVERSITY (US) 2011-07-28 US disclosed
US-7943362-B2 Biosynthesis of phloroglucinol and preparation of 1,3-dihydroxybenzene therefrom BOARD OF TRUSTEES OF MICHIGAN STATE UNIVERSITY (US) 2011-05-17 US disclosed