SCHEMBL4597818

SCHEMBL4597818

O=C(OOOOC1CCCCC1)OOOC1CCCCC1

nearest known ligand 0.35

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 2/20 0.35
NPC1 O15118 1/20 0.33
MAPT P10636 1/20 0.33
RAB9A P51151 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
CES2 O00748 1/20 0.32
CES1 P23141 1/20 0.32
CYP2C19 P33261 1/20 0.32
CA1 P00915 2/20 0.31
CA2 P00918 2/20 0.31
NAAA Q02083 1/20 0.31
CA12 O43570 1/20 0.30
CA9 Q16790 1/20 0.30
CYP19A1 P11511 1/20 0.30
HTT P42858 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
SCHEMBL960718 0.96 EPHX1 (0.38) EPHX1NPC1MAPTRAB9ASMN1; SMN2
SCHEMBL11669033 0.96 EPHX1 (0.38) EPHX1NPC1MAPTRAB9ASMN1; SMN2
SCHEMBL9649772 0.87 EPHX1 (0.35) EPHX1NPC1MAPTRAB9ASMN1; SMN2
SCHEMBL22733772 0.81 EPHX1 (0.40) EPHX1NPC1MAPTRAB9ASMN1; SMN2
SCHEMBL7778970 0.80 EPHX1 (0.36) EPHX1NPC1MAPTRAB9ASMN1; SMN2
SCHEMBL7106072 0.79 EPHX1 (0.39) EPHX1NPC1MAPTRAB9ASMN1; SMN2
SCHEMBL29525024 0.79 EPHX1 (0.37) EPHX1CES2CES1CYP2C19CA1
SCHEMBL5025863 0.77 EPHX1 (0.47) EPHX1SMN1; SMN2CES2CES1CYP2C19
SCHEMBL29022117 0.77 EPHX1 (0.34) EPHX1NPC1MAPTRAB9ASMN1; SMN2
SCHEMBL3476719 0.72 CA1 (0.34) EPHX1CA1CA2CA12CA9

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
EP-1477540-B1 Adhesive tape TESA AG (DE) 2008-04-09 EP disclosed
EP-1471127-B1 Process for crosslinking acrylate hot-melt adhesives TESA AG (DE) 2007-01-10 EP disclosed
EP-1709133-A1 ORIENTATED ACRYLATE ADHESIVE MATERIALS, METHOD FOR THE PRODUCTION AND USE THEREOF tesa AG (DE) 2006-10-11 EP disclosed
EP-1361260-B1 Use of macromonomers for the production of acrylate adhesives TESA AG (DE) 2005-08-17 EP disclosed
WO-2005068575-A1 ORIENTATED ACRYLATE ADHESIVE MATERIALS, METHOD FOR THE PRODUCTION AND USE THEREOF TESA AG (DE) 2005-07-28 WO disclosed
EP-1477540-A2 Adhesive tape tesa AG (DE) 2004-11-17 EP disclosed
EP-1471127-A1 Process for crosslinking acrylate hot-melt adhesives tesa AG (DE) 2004-10-27 EP disclosed
EP-1453930-A1 METHOD FOR PRODUCING ORIENTED ACRYLATE HOTMELTS tesa AG (DE) 2004-09-08 EP disclosed
EP-1361260-A2 Use of macromonomers for the production of acrylate adhesives tesa AG (DE) 2003-11-12 EP disclosed
WO-2003044119-A1 METHOD FOR PRODUCING ORIENTED ACRYLATE HOTMELTS TESA AG (DE) 2003-05-30 WO disclosed