SCHEMBL3223191

SCHEMBL3223191

CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC(C)C

nearest known ligand 0.55

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
OPRM1 P35372 1/20 0.55
TSHR P16473 1/20 0.53
THRB P10828 1/20 0.53
LMNA P02545 2/20 0.53
DNM1 Q05193 2/20 0.50
SPHK1 Q9NYA1 1/20 0.50
ADH1B P00325 1/20 0.46
ADH1C P00326 1/20 0.46
ADH1A P07327 1/20 0.46
ADH4 P08319 1/20 0.46
ADH7 P40394 1/20 0.46
PLA2G1B P04054 1/20 0.46
PLA2G2A P14555 1/20 0.46
ACE2 Q9BYF1 1/20 0.44
FDPS P14324 3/20 0.44
GPR84 Q9NQS5 2/20 0.44

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
SCHEMBL3002559 1.00 OPRM1 (0.55) OPRM1TSHRTHRBLMNADNM1
SCHEMBL671913 1.00 OPRM1 (0.55) OPRM1TSHRTHRBLMNADNM1
SCHEMBL6122664 1.00 OPRM1 (0.55) OPRM1TSHRTHRBLMNADNM1
SCHEMBL15148 1.00 OPRM1 (0.55) OPRM1TSHRTHRBLMNADNM1
SCHEMBL157759 1.00 OPRM1 (0.55) OPRM1TSHRTHRBLMNADNM1
Hexadecane SCHEMBL23000686 1.00 OPRM1 (0.55) OPRM1TSHRTHRBLMNADNM1
SCHEMBL344997 1.00 OPRM1 (0.55) OPRM1TSHRTHRBLMNADNM1
Octane SCHEMBL7455770 1.00 OPRM1 (0.55) OPRM1TSHRTHRBLMNADNM1
SCHEMBL22950680 1.00 OPRM1 (0.55) OPRM1TSHRTHRBLMNADNM1
SCHEMBL598884 1.00 OPRM1 (0.55) OPRM1TSHRTHRBLMNADNM1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100062029-A1 Product for the Targeted Release of Active Substances LTS LOHMANN THERAPIE-SYSTEME AG (DE) 2010-03-11 US disclosed
EP-1858387-B1 PRODUCT FOR THE TARGETED RELEASE OF TWO-COMPARTMENT ACTIVE SUBSTANCES SCS SKIN CARE SYSTEMS GMBH (DE) 2009-06-17 EP disclosed
US-20080145388-A1 cosmetic cleaning product for controlling release; two layers define a compartment between them, which contains the active substance and optionally a gas-releasing component; one is impermeable, and one is permeable to the active substance; single use for body care; glove shape LTS LOHMANN THERAPIE-SYSTEME AG (DE) 2008-06-19 US disclosed
EP-1858387-A1 PRODUCT FOR THE TARGETED RELEASE OF TWO-COMPARTMENT ACTIVE SUBSTANCES SCS Skin Care Systems GmbH (DE) 2007-11-28 EP disclosed
EP-1859020-A1 PRODUCT FOR THE TARGETED RELEASE OF ACTIVE SUBSTANCES SCS Skin Care Systems GmbH (DE) 2007-11-28 EP disclosed
WO-2006097171-A1 PRODUCT FOR THE TARGETED RELEASE OF ACTIVE SUBSTANCES SCS SKIN CARE SYSTEMS GMBH (DE) 2006-09-21 WO disclosed
WO-2006097170-A1 PRODUCT FOR THE TARGETED RELEASE OF TWO-COMPARTMENT ACTIVE SUBSTANCES SCS SKIN CARE SYSTEMS GMBH (DE) 2006-09-21 WO disclosed
US-20060052263-A1 Soap preparation with air bubbles SCS SKIN CARE SYSTEMS GMBH 2006-03-09 US disclosed
EP-1534813-A1 SOAP PREPARATION WITH AIR BUBBLES SCS Skin Care Systems GmbH (DE) 2005-06-01 EP disclosed
WO-2004024113-A1 PATCH FOR ADMINISTERING DEODORANTS SCS SKIN CARE SYSTEMS GMBH (DE) 2004-03-25 WO disclosed
WO-2004022689-A1 SOAP PREPARATION WITH AIR BUBBLES SCS SKIN CARE SYSTEMS GMBH (DE) 2004-03-18 WO disclosed