SCHEMBL156011

SCHEMBL156011

CC(=O)OCCC(C)(C)CC(C)C

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.39
TSHR P16473 3/20 0.38
CHRM5 P08912 2/20 0.38
CHRM1 P11229 2/20 0.38
CHRM3 P20309 2/20 0.38
PGR P06401 1/20 0.38
CHRM2 P08172 1/20 0.38
CHRM4 P08173 1/20 0.38
HTR1A P08908 1/20 0.38
CHRNB2 P17787 1/20 0.38
TBXA2R P21731 1/20 0.38
CHRNB4 P30926 1/20 0.38
CHRNA3 P32297 1/20 0.38
CHRNA7 P36544 1/20 0.38
CHRNA4 P43681 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
CHRNA10 Q9GZZ6 1/20 0.38
CHRNA9 Q9UGM1 1/20 0.38
ALOX15 P16050 1/20 0.37
GALR3 O60755 2/20 0.36

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
SCHEMBL665126 0.82 TSHR (0.52) ALDH1A1TSHRMMP8TDP1
SCHEMBL2916859 0.79 MMP8 (0.38) ALDH1A1TSHRCHRM5CHRM1CHRM3
SCHEMBL666008 0.78 TSHR (0.52) ALDH1A1TSHRSMN1; SMN2MMP8LMNA
SCHEMBL11621251 0.77 ALDH1A1 (0.43) ALDH1A1TSHRCHRM5CHRM1CHRM3
SCHEMBL15542551 0.77 ALDH1A1 (0.48) ALDH1A1TSHRCHRM5CHRM1CHRM3
SCHEMBL15541810 0.75 ALDH1A1 (0.52) ALDH1A1TSHRCHRM5CHRM1CHRM3
SCHEMBL4229823 0.73 ALDH1A1 (0.48) ALDH1A1TSHRCHRM5CHRM1CHRM3
SCHEMBL7944053 0.73
SCHEMBL1477029 0.73 TSHR (0.37) ALDH1A1TSHRCHRM5CHRM1CHRM3
SCHEMBL22238974 0.72 ALDH1A1 (0.33) ALDH1A1TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2435485-B1 A POLYMER MADE OF A PRIMARY AMINE FUNCTIONALIZED POLYMER AND A HEMICELLULOSE CELLUTECH AB (SE) 2019-01-09 EP disclosed
US-9133578-B2 Polymer made of a primary amine functionalized polymer and a hemicellulose CELLUTECH AB (SE) 2015-09-15 US disclosed
US-20120058536-A1 POLYMER MADE OF A PRIMARY AMINE FUNCTIONALIZED POLYMER AND A HEMICELLULOSE SWETREE TECHNOLOGIES AB (SE) 2012-03-08 US disclosed
US-8021436-B2 Cleaning and/or treatment compositions comprising a xyloglucan conjugate THE PROCTER & GAMBLE COMPANY (US) 2011-09-20 US disclosed
EP-1632281-B1 Process for absorbing hydrophobic substances in polymers having an hollow structure ROHM & HAAS (US) 2011-09-14 EP disclosed
WO-2010138069-A1 A POLYMER MADE OF A PRIMARY AMINE FUNCTIONALIZED POLYMER AND A HEMICELLULOSE SWETREE TECHNOLOGIES AB (SE) 2010-12-02 WO disclosed
EP-0950087-B1 COMPOSITIONS CONTAINING PERFUME GIVAUDAN NEDERLAND SERVICES B (NL) 2010-08-11 EP disclosed
EP-2193189-A2 CLEANING AND/OR TREATMENT COMPOSITIONS The Procter & Gamble (US) 2010-06-09 EP disclosed
US-20090088362-A1 Cleaning and/or treatment compositions PROCTER & GAMBLE COMPANY, THE 2009-04-02 US disclosed
WO-2009040731-A2 CLEANING AND/OR TREATMENT COMPOSITIONS THE PROCTER & GAMBLE COMPANY (US) 2009-04-02 WO disclosed
EP-0826026-B1 PARTICLES CONTAINING PERFUME UNILEVER PLC (GB) 2001-05-09 EP disclosed
US-6194375-B1 VINYL ALCOHOL POLYMERS QUEST INTERNATIONAL B.V. (NL) 2001-02-27 US disclosed
WO-2000071666-A1 DETERGENT COMPOSITIONS UNILEVER PLC (GB) 2000-11-30 WO disclosed
EP-1047726-A1 POLYSACCHARIDE CONJUGATES CAPABLE OF BINDING TO CELLULOSE QUEST INTERNATIONAL B.V. (NL) 2000-11-02 EP disclosed
WO-2000046337-A1 DETERGENT COMPOSITION QUEST INTERNATIONAL B.V. (NL) 2000-08-10 WO disclosed
US-6024943-A POLYMER CORES WITH COATINGS QUEST INTERNATIONAL B.V. (NL) 2000-02-15 US disclosed
WO-1999036470-A1 POLYSACCHARIDE CONJUGATES CAPABLE OF BINDING TO CELLULOSE QUEST INTERNATIONAL B.V. (NL) 1999-07-22 WO disclosed
EP-0930334-A1 Polysaccharide conjugate capable of binding cellulose QUEST INTERNATIONAL B.V. (NL) 1999-07-21 EP disclosed
EP-0826026-A1 PARTICLES CONTAINING PERFUME UNILEVER PLC (GB) 1998-03-04 EP disclosed
WO-1996021719-A1 PARTICLES CONTAINING PERFUME UNILEVER PLC (GB) 1996-07-18 WO disclosed