SCHEMBL5699545

SCHEMBL5699545

CC(C)CCCCCC(C)OC(=O)C(C#N)=C(c1ccccc1)c1ccccc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.52
LMNA P02545 3/20 0.52
MAPK1 P28482 3/20 0.52
MAPT P10636 1/20 0.36
XBP1 P17861 1/20 0.36
RAB9A P51151 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
RARB P10826 1/20 0.35
KDM4E B2RXH2 1/20 0.35
KMT2A Q03164 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
HPGD P15428 1/20 0.34
CTSL P07711 2/20 0.33
CYP1A2 P05177 1/20 0.33
CYP2D6 P10635 1/20 0.33
CTSB P07858 1/20 0.33
CTSS P25774 1/20 0.33
CTSK P43235 1/20 0.33
POLB P06746 1/20 0.33
SCN1A P35498 1/20 0.33

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
SCHEMBL17417889 0.85 ALDH1A1 (0.56) ALDH1A1LMNAMAPK1MAPTXBP1
SCHEMBL9654433 0.85 ALDH1A1 (0.58) ALDH1A1LMNAMAPK1MAPTXBP1
SCHEMBL78385 0.85 ALDH1A1 (0.58) ALDH1A1LMNAMAPK1MAPTXBP1
Etocrylene SCHEMBL7199053 0.81 ALDH1A1 (0.56) ALDH1A1LMNAMAPK1MAPTRAB9A
SCHEMBL9068628 0.80 ALDH1A1 (0.52) ALDH1A1LMNAMAPK1MAPTXBP1
SCHEMBL11408016 0.78 ALDH1A1 (0.51) ALDH1A1LMNAMAPK1MAPTXBP1
SCHEMBL18012244 0.78 ALDH1A1 (0.58) ALDH1A1LMNAMAPK1NAAA
SCHEMBL18012240 0.78 ALDH1A1 (0.58) ALDH1A1LMNAMAPK1NAAA
SCHEMBL18012239 0.78 ALDH1A1 (0.58) ALDH1A1LMNAMAPK1NAAA
SCHEMBL28676919 0.78 ALDH1A1 (0.58) ALDH1A1LMNAMAPK1MAPTXBP1

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-20060189731-A1 Stabilizing composition for chlorine-containing polymers ARKEMA FRANCE (FR) 2006-08-24 US disclosed
US-20060148941-A1 Monosubstituted 6-aminouracils for the stabilization of halogenated polymers CHEMTURA VINYL ADDITIVES GMBH (DE) 2006-07-06 US disclosed
EP-1669397-A1 Stabilizing compositions for chlorine-containing polymers and resins Arkema (FR) 2006-06-14 EP disclosed
EP-1644435-A2 STABILIZING COMPOSITION FOR CHLORINE-CONTAINING POLYMERS ARKEMA (FR) 2006-04-12 EP disclosed
WO-2005005530-A2 STABILIZING COMPOSITION FOR CHLORINE-CONTAINING POLYMERS ARKEMA (FR) 2005-01-20 WO disclosed
EP-1496083-A1 Stabilizing composition for chlorine-containing polymers ARKEMA (FR) 2005-01-12 EP disclosed
US-6274654-B1 1,3-Disubstituted 6-aminouracils for stabilizing halogenated polymers WITCO VINYL ADDITIVES GMBH (DE) 2001-08-14 US disclosed
US-6211270-B1 HEAT AND LIGHT STABILIZERS FOR POLYMERS WITCO VINYL ADDITIVES GMBH (DE) 2001-04-03 US disclosed
US-6174941-B1 FOR STABILIZING CHLORINE CONTAINING POLYMERS SUCH AS POLYVINYL CHLORIDE WITCO VINYL ADDITIVES GMBH (DE) 2001-01-16 US disclosed
US-6156830-A 5-substituted 6-aminouracils as stabilizers for halogenated polymers WITCO VINYL ADDITIVES GMBH (DE) 2000-12-05 US disclosed
US-6084013-A MIXTURES OF SUBSTITUTED URACILS OR THIURACILS WITH ALUMINUM CALCIUM HYDROXIDES, PHOSPHITES AND CARBONATES OR THEIR HYDRATES, ALSO LITHIUM LAYERED LATTICE COMPOUNDS AND TITANIUM HYDROTALCITES, FOR POLYVINYL CHLORIDE WITCO VINYL ADDITIVES GMBH (DE) 2000-07-04 US disclosed