SCHEMBL5046422

SCHEMBL5046422

CC(=O)OCOC(=O)NCC1(OC(C)=O)CCCCC1

nearest known ligand 0.38

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
P2RX7 Q99572 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
SCHEMBL6024135 0.88
SCHEMBL27485317 0.82 TSHR (0.39) P2RX7
SCHEMBL27554172 0.80 HCRTR2 (0.41) P2RX7
SCHEMBL1727795 0.80 ACHE (0.32) P2RX7
SCHEMBL3813044 0.78 P2RX7 (0.31) P2RX7
SCHEMBL3808910 0.78 CTSK (0.30)
SCHEMBL3813627 0.78 HCRTR2 (0.32)
SCHEMBL6023653 0.77 NAAA (0.41)
SCHEMBL27484249 0.76 SLC6A4 (0.33)
SCHEMBL597825 0.76 ALDH1A1 (0.44)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1608357-A4 TREATING OR PREVENTING HOT FLASHES USING PRODRUGS OF GABA ANALOGS XENOPORT INC (US) 2008-03-26 EP disclosed
EP-1608357-A2 TREATING OR PREVENTING HOT FLASHES USING PRODRUGS OF GABA ANALOGS Xenoport, Inc. (US) 2005-12-28 EP disclosed
WO-2004089289-A2 TREATING OR PREVENTING HOT FLASHES USING PRODRUGS OF GABA ANALOGS XENOPORT, INC. (US) 2004-10-21 WO disclosed