SCHEMBL874717

SCHEMBL874717

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

nearest known ligand 0.46

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.46
KDM6B O15054 1/20 0.46
KDM5C P41229 1/20 0.46
EGLN1 Q9GZT9 1/20 0.46
PHF8 Q9UPP1 1/20 0.46
KDM2A Q9Y2K7 1/20 0.46
MGAM O43451 1/20 0.35
GAA P10253 1/20 0.35
SI P14410 1/20 0.35
MGAM2 Q2M2H8 1/20 0.35
HTT P42858 1/20 0.32
LMNA P02545 1/20 0.31
SLC15A2 Q16348 1/20 0.31
ALDH1A1 P00352 2/20 0.30
TDP1 Q9NUW8 1/20 0.30

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
SCHEMBL14335056 1.00 KDM4E (0.46) KDM4EKDM6BKDM5CEGLN1PHF8
SCHEMBL5574000 0.95
Phosphine SCHEMBL28295591 0.92 KDM4E (0.48) KDM4EKDM6BKDM5CEGLN1PHF8
Cyclohexane SCHEMBL11698850 0.88 KDM4E (0.44) KDM4EKDM6BKDM5CEGLN1PHF8
SCHEMBL28257446 0.84 ALDH1A1 (0.30) ALDH1A1
SCHEMBL28427478 0.83 KDM4E (0.62) KDM4EKDM6BKDM5CEGLN1PHF8
SCHEMBL10936077 0.81 KDM4E (0.55) KDM4EKDM6BKDM5CEGLN1PHF8
SCHEMBL26967576 0.81 KDM4E (0.55) KDM4EKDM6BKDM5CEGLN1PHF8
SCHEMBL29241906 0.79 KDM4E (0.52) KDM4EKDM6BKDM5CEGLN1PHF8
SCHEMBL7266153 0.78 KDM4E (0.40) KDM4EKDM6BKDM5CEGLN1PHF8

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
US-8143035-B2 Pantothenate kinase overexpression and pantothenic acid supplementation in actinomycetes RICE UNIVERSITY (US) 2012-03-27 US disclosed