SCHEMBL3270939

SCHEMBL3270939

CCCCCCCCCCC1CCN(CCCCCCCCCC)C1=O

nearest known ligand 0.45

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
GBA1 P04062 1/20 0.45
ALDH1A1 P00352 1/20 0.40
CYP1A2 P05177 2/20 0.39
BCHE P06276 2/20 0.38
GNAI3 P08754 1/20 0.38
GNAO1 P09471 1/20 0.38
GNAI1 P63096 1/20 0.38
ALOX5 P09917 2/20 0.37
CHRNB2 P17787 1/20 0.37
CHRNA7 P36544 1/20 0.37
CHRNA4 P43681 1/20 0.37
PTGS1 P23219 3/20 0.37
PTGS2 P35354 3/20 0.37
MGLL Q99685 2/20 0.37
FAAH O00519 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
SCHEMBL6130819 1.00 GBA1 (0.45) GBA1ALDH1A1CYP1A2BCHEGNAI3
SCHEMBL8602272 1.00 GBA1 (0.45) GBA1ALDH1A1CYP1A2BCHEGNAI3
SCHEMBL9474303 1.00 GBA1 (0.45) GBA1ALDH1A1CYP1A2BCHEGNAI3
SCHEMBL11775340 1.00 GBA1 (0.45) GBA1ALDH1A1CYP1A2BCHEGNAI3
SCHEMBL6535779 1.00 GBA1 (0.45) GBA1ALDH1A1CYP1A2BCHEGNAI3
SCHEMBL28942756 0.98 GBA1 (0.44) GBA1ALDH1A1CYP1A2BCHEGNAI3
SCHEMBL9568882 0.98 GBA1 (0.43) GBA1ALDH1A1CYP1A2BCHEGNAI3
SCHEMBL474124 0.97 GBA1 (0.42) GBA1ALDH1A1CYP1A2BCHEGNAI3
SCHEMBL3957901 0.93 CYP1A2 (0.39) GBA1ALDH1A1CYP1A2BCHEGNAI3
SCHEMBL7759537 0.89 GBA1 (0.39) GBA1ALDH1A1CYP1A2BCHECHRNB2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9056060-B2 Non-reactive adhesive useful in transdermal drug delivery system HENKEL AG & CO. KGAA (DE) 2015-06-16 US disclosed
EP-1318843-B1 ACRYL ADHESIVE USEFUL IN TRANSDERMAL DRUG DELIVERY SYSTEMS HENKEL AG & CO KGAA (DE) 2013-04-17 EP disclosed
EP-1347789-B1 HOT MELT ADHESIVES FOR DERMAL APPLICATION HENKEL AG & CO KGAA (DE) 2010-06-09 EP disclosed
EP-1347789-A2 HOT MELT ADHESIVES FOR DERMAL APPLICATION National Starch and Chemical Investment Holding Corporation (US) 2003-10-01 EP disclosed
EP-1318843-A2 ACRYL ADHESIVE USEFUL IN TRANSDERMAL DRUG DELIVERY SYSTEMS National Starch and Chemical Investment Holding Corporation (US) 2003-06-18 EP disclosed
US-20020128345-A1 Hot melt adhesives for dermal application Henkel IP & Holding GmbH (DE) 2002-09-12 US disclosed
US-6448303-B1 HIGH MOLECULAR WEIGHT RUBBER AND LESS THAN ABOUT 60 PARTS BY WEIGHT OF A LIQUID DILUENT, AND HAVING A G' OF LESS THAN ABOUT 15 X 104 DYNES/CM2 AT 10 RAD/S AT 25 DEGREES C. NATIONAL STARCH AND CHEMICAL INVESTMENT HOLDING CORPORATION 2002-09-10 US disclosed
WO-2002053197-A2 HOT MELT ADHESIVES FOR DERMAL APPLICATION NATIONAL STARCH AND CHEMICAL INVESTMENT HOLDING CORPORATION (US) 2002-07-11 WO disclosed
US-20020077437-A1 Non-reactive adhesive useful in transdermal drug delivery system HENKEL KGAA (DE) 2002-06-20 US disclosed
WO-2002024157-A2 ACRYL ADHESIVE USEFUL IN TRANSDERMAL DRUG DELIVERY SYSTEMS NATIONAL STARCH AND CHEMICAL INVESTMENT HOLDING CORPORATION (US) 2002-03-28 WO disclosed