SCHEMBL3817060

SCHEMBL3817060

CCC[N+]1(CCO)CCCC1

nearest known ligand 0.77

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.33
RAB9A P51151 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.31
CTDSP1 Q9GZU7 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
SCHEMBL4906438 0.87 PTK2 (0.32) L3MBTL1
SCHEMBL898705 0.87 NPC1 (0.38) NPC1RAB9AL3MBTL1CTDSP1
SCHEMBL3812730 0.86 ALDH1A1 (0.38)
SCHEMBL3812431 0.86 ALDH1A1 (0.38) NPC1RAB9A
SCHEMBL22500693 0.84 ALDH1A1 (0.36) NPC1RAB9AL3MBTL1CTDSP1
SCHEMBL3814229 0.84 SMN1; SMN2 (0.40) NPC1RAB9A
SCHEMBL4893255 0.84 PTK2 (0.31)
Hydrochloric Acid SCHEMBL29251751 0.84 NPC1 (0.37) NPC1RAB9AL3MBTL1CTDSP1
Water SCHEMBL21840772 0.84 NPC1 (0.37) NPC1RAB9AL3MBTL1CTDSP1
Fluoride Ion SCHEMBL29252345 0.84 NPC1 (0.37) NPC1RAB9AL3MBTL1CTDSP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090242414-A1 ELECTRONCHEMICAL DEPOSITION OF TANTALUM AND/OR COPPER IN IONIC LIQUIDS MERCK PATENT GMBH (DE) 2009-10-01 US claimed
EP-1951934-B1 ELECTROCHEMICAL DEPOSITION OF SELENIUM IN IONIC LIQUIDS MERCK PATENT GMBH (DE) 2009-08-19 EP claimed
US-20080210566-A1 Electrochemical Deposition of Selenium in Ionic Liquids MERCK PATENT GESELLSCHAFT (DE) 2008-09-04 US claimed
EP-1951934-A1 ELECTROCHEMICAL DEPOSITION OF SELENIUM IN IONIC LIQUIDS Merck Patent GmbH (DE) 2008-08-06 EP claimed
EP-1831433-A2 ELECTROCHEMICAL DEPOSITION OF TANTALUM AND/OR COPPER IN IONIC LIQUIDS Merck Patent GmbH (DE) 2007-09-12 EP claimed
WO-2007039035-A1 ELECTROCHEMICAL DEPOSITION OF SELENIUM IN IONIC LIQUIDS MERCK PATENT GMBH (DE) 2007-04-12 WO claimed
WO-2006061081-A2 ELECTROCHEMICAL DEPOSITION OF TANTALUM AND/OR COPPER IN IONIC LIQUIDS MERCK PATENT GMBH (DE) 2006-06-15 WO claimed
US-20090242414-A1 ELECTRONCHEMICAL DEPOSITION OF TANTALUM AND/OR COPPER IN IONIC LIQUIDS MERCK PATENT GMBH (DE) 2009-10-01 US disclosed
EP-1951934-B1 ELECTROCHEMICAL DEPOSITION OF SELENIUM IN IONIC LIQUIDS MERCK PATENT GMBH (DE) 2009-08-19 EP disclosed
US-20080210566-A1 Electrochemical Deposition of Selenium in Ionic Liquids MERCK PATENT GESELLSCHAFT (DE) 2008-09-04 US disclosed
EP-1951934-A1 ELECTROCHEMICAL DEPOSITION OF SELENIUM IN IONIC LIQUIDS Merck Patent GmbH (DE) 2008-08-06 EP disclosed
EP-1831433-A2 ELECTROCHEMICAL DEPOSITION OF TANTALUM AND/OR COPPER IN IONIC LIQUIDS Merck Patent GmbH (DE) 2007-09-12 EP disclosed
WO-2007039035-A1 ELECTROCHEMICAL DEPOSITION OF SELENIUM IN IONIC LIQUIDS MERCK PATENT GMBH (DE) 2007-04-12 WO disclosed
WO-2006061081-A2 ELECTROCHEMICAL DEPOSITION OF TANTALUM AND/OR COPPER IN IONIC LIQUIDS MERCK PATENT GMBH (DE) 2006-06-15 WO disclosed