SCHEMBL2846274

SCHEMBL2846274

NC(=O)CCCC1(C(N)=O)CCCCCCCCCCCC1

nearest known ligand 0.38

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CYP2C19 P33261 1/20 0.38
CYP4F2 P78329 1/20 0.37
CYP4A11 Q02928 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.36
TBXAS1 P24557 2/20 0.33
CETP P11597 5/20 0.32
USP2 O75604 1/20 0.31
ALDH1A1 P00352 1/20 0.31
LMNA P02545 1/20 0.31
CYP1A2 P05177 1/20 0.31
TSHR P16473 1/20 0.31
BLM P54132 1/20 0.31
CACNA2D1 P54289 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
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
SCHEMBL2801502 1.00 CYP2C19 (0.38) CYP2C19CYP4F2CYP4A11L3MBTL1TBXAS1
SCHEMBL1903896 1.00 CYP2C19 (0.38) CYP2C19CYP4F2CYP4A11L3MBTL1TBXAS1
SCHEMBL15125053 1.00 CYP2C19 (0.38) CYP2C19CYP4F2CYP4A11L3MBTL1TBXAS1
SCHEMBL11037884 1.00 CYP2C19 (0.38) CYP2C19CYP4F2CYP4A11L3MBTL1TBXAS1
SCHEMBL277881 1.00 CYP2C19 (0.38) CYP2C19CYP4F2CYP4A11L3MBTL1TBXAS1
SCHEMBL45602 1.00 CYP2C19 (0.38) CYP2C19CYP4F2CYP4A11L3MBTL1TBXAS1
SCHEMBL277982 1.00 CYP2C19 (0.38) CYP2C19CYP4F2CYP4A11L3MBTL1TBXAS1
SCHEMBL277294 0.98 CYP4F2 (0.38) CYP2C19CYP4F2CYP4A11L3MBTL1TBXAS1
SCHEMBL9284588 0.94 CYP4F2 (0.40) CYP2C19CYP4F2CYP4A11L3MBTL1TBXAS1
SCHEMBL275955 0.94 CYP4F2 (0.40) CYP2C19CYP4F2CYP4A11L3MBTL1TBXAS1

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 216 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070020418-A1 Acetaldehyde scavenging by addition of active scavengers to bottle closures HOWELL EARL E JR 2007-01-25 US claimed
EP-1739026-A1 Acetaldehyde scavenging by addition of active scavengers to bottle closures Eastman Chemical Company (US) 2007-01-03 EP claimed
EP-1442993-B1 Acetaldehyde scavening by addition of active scavengers to bottle closures EASTMAN CHEM CO (US) 2006-11-08 EP claimed
EP-1442993-A1 Acetaldehyde scavening by addition of active scavengers to bottle closures EASTMAN CHEMICAL COMPANY (US) 2004-08-04 EP claimed
US-20040146674-A1 Acetaldehyde scavenging by addition of active scavengers to bottle closures EASTMAN CHEMICAL COMPANY 2004-07-29 US claimed
EP-1161497-B1 POLYAMIDE/EMULSION POLYMER BLENDS EASTMAN CHEM CO (US) 2003-05-07 EP claimed
EP-0925330-B1 PROCESS FOR IMPROVING THE FLAVOR RETAINING PROPERTY OF POLYESTER/POLYAMIDE BLEND CONTAINERS FOR OZONATED WATER EASTMAN CHEM CO (US) 2003-05-07 EP claimed
JP-2003503518-A 2003-01-28 JP claimed
JP-2002538259-A 2002-11-12 JP claimed
US-20020107319-A1 Polyamide/emulsion polymer blends EASTMAN CHEMICAL COMPANY 2002-08-08 US claimed
EP-0964893-A1 NAPHTHALENEDICARBOXYLATE CONTAINING POLYESTER/POLYAMIDE BLEND HAVING IMPROVED FLAVOR RETAINING PROPERTY EASTMAN CHEMICAL COMPANY (US) 1999-12-22 EP claimed
WO-1999058328-A2 MULTILAYER POLYMER COMPOSITIONS DISPLAYING IMROVED RECYCLABILITY EASTMAN CHEMICAL COMPANY (US) 1999-11-18 WO claimed
US-5985389-A POLESTER OR POLYAMIDEESTER ACETALDEHYDE REDUCING COMPOUND; FOOD AND BEVERAGE CONTAINERS; CLARITY EASTMAN CHEMICAL COMPANY (US) 1999-11-16 US claimed
EP-0925330-A1 PROCESS FOR IMPROVING THE FLAVOR RETAINING PROPERTY OF POLYESTER/POLYAMIDE BLEND CONTAINERS FOR OZONATED WATER EASTMAN CHEMICAL COMPANY (US) 1999-06-30 EP claimed
WO-1998039388-A1 NAPHTHALENEDICARBOXYLATE CONTAINING POLYESTER/POLYAMIDE BLEND HAVING IMPROVED FLAVOR RETAINING PROPERTY EASTMAN CHEMICAL COMPANY (US) 1998-09-11 WO claimed
EP-0857194-A1 POLYESTER/POLYAMIDE BLEND HAVING IMPROVED FLAVOR RETAINING PROPERTY AND CLARITY EASTMAN CHEMICAL COMPANY (US) 1998-08-12 EP claimed
WO-1998007786-A1 PROCESS FOR IMPROVING THE FLAVOR RETAINING PROPERTY OF POLYESTER/POLYAMIDE BLEND CONTAINERS FOR OZONATED WATER EASTMAN CHEMICAL COMPANY (US) 1998-02-26 WO claimed
US-5650469-A Polyester/polyamide blend having improved flavor retaining property and clarity EASTMAN CHEMICAL COMPANY (US) 1997-07-22 US claimed
WO-1997015629-A1 POLYESTER/POLYAMIDE BLEND HAVING IMPROVED FLAVOR RETAINING PROPERTY AND CLARITY EASTMAN CHEMICAL COMPANY (US) 1997-05-01 WO claimed
US-3966838-A Polyamide base powder coating material CHEMISCHE WERKE HULS AKTIENGESELLSCHAFT (DT) 1976-06-29 US claimed