SCHEMBL6444620

SCHEMBL6444620

C=CCOc1ccc(C(=O)C(=O)OCC)cc1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.57
NPC1 O15118 3/20 0.57
RAB9A P51151 2/20 0.57
POLB P06746 1/20 0.57
SMN1; SMN2 Q16637 1/20 0.57
CHRNB2 P17787 6/20 0.48
CHRNB4 P30926 6/20 0.48
CHRNA3 P32297 6/20 0.48
CHRNA4 P43681 6/20 0.48
ADRB2 P07550 1/20 0.47
ADRB1 P08588 1/20 0.47
ADRB3 P13945 1/20 0.47
ALDH1A1 P00352 3/20 0.45
L3MBTL1 Q9Y468 1/20 0.44
CA12 O43570 1/20 0.43
CA1 P00915 1/20 0.43
CA2 P00918 1/20 0.43
CA7 P43166 1/20 0.43
CA9 Q16790 1/20 0.43
KDM4E B2RXH2 2/20 0.43

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
SCHEMBL18790798 0.86 NPC1 (0.69) MAPTNPC1RAB9APOLBSMN1; SMN2
SCHEMBL1515794 0.84 MAPT (0.59) MAPTNPC1RAB9APOLBSMN1; SMN2
SCHEMBL2666728 0.84 NPC1 (0.56) MAPTNPC1RAB9APOLBSMN1; SMN2
SCHEMBL11430643 0.84 PARP10 (0.59) MAPTNPC1RAB9AALDH1A1L3MBTL1
SCHEMBL18766371 0.84 NPC1 (0.56) MAPTNPC1RAB9APOLBSMN1; SMN2
SCHEMBL21636224 0.82 L3MBTL1 (0.54) MAPTRAB9AALDH1A1L3MBTL1PARP10
SCHEMBL21636259 0.81 L3MBTL1 (0.53) MAPTNPC1POLBL3MBTL1
SCHEMBL7310001 0.81 NPC1 (0.56) MAPTNPC1RAB9APOLBSMN1; SMN2
SCHEMBL5204910 0.81 MAPT (0.56) MAPTNPC1RAB9APOLBSMN1; SMN2
SCHEMBL12732996 0.80 L3MBTL1 (0.57) MAPTSMN1; SMN2ALDH1A1L3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8414982-B2 Process for the production of strongly adherent coatings BASF SE (DE) 2013-04-09 US disclosed
US-20090092768-A1 Process for the Production of Strongly Adherent Coatings CIBA SPECIALTY CHEMICALS CORP. 2009-04-09 US disclosed
US-6906113-B2 Surface-active photoinitiators CIBA SPECIALTY CHEMICALS CORP. (US) 2005-06-14 US disclosed
US-20040014832-A1 Surface-active photoinitiators CIBA SPECIALTY CHEMICALS CORP. 2004-01-22 US disclosed
EP-1309599-A1 SURFACE-ACTIVE PHOTOINITIATORS Ciba SC Holding AG (CH) 2003-05-14 EP disclosed
WO-2002014326-A1 SURFACE-ACTIVE PHOTOINITIATORS CIBA SPECIALTY CHEMICALS HOLDING INC. (CH) 2002-02-21 WO disclosed