SCHEMBL8665338

SCHEMBL8665338

C=CC(=O)OCCCCC(CC)C(=O)O

nearest known ligand 0.56

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
TSHR P16473 7/20 0.56
ALDH1A1 P00352 4/20 0.56
CYP3A4 P08684 2/20 0.56
HPGD P15428 1/20 0.56
CA2 P00918 2/20 0.50
MAPK1 P28482 2/20 0.50
TP53 P04637 3/20 0.43
HIF1A Q16665 3/20 0.43
HSD17B10 Q99714 1/20 0.43
THRB P10828 2/20 0.41
HCAR2 Q8TDS4 3/20 0.40
CA1 P00915 1/20 0.39
ATM Q13315 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.36
GRIK1 P39086 2/20 0.36
GRIK2 Q13002 2/20 0.36
SLC1A2 P43004 1/20 0.36
SLC1A1 P43005 1/20 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
SCHEMBL5050829 0.95 TSHR (0.58) TSHRALDH1A1CYP3A4HPGDCA2
2-Ethylhexanoic Acid SCHEMBL27664726 0.89 TSHR (0.53) TSHRALDH1A1CYP3A4HPGDCA2
SCHEMBL29448450 0.89 TSHR (0.64) TSHRALDH1A1CYP3A4HPGDCA2
SCHEMBL27856672 0.88 TSHR (0.52) TSHRALDH1A1CYP3A4HPGDCA2
SCHEMBL27887847 0.88 TSHR (0.62) TSHRALDH1A1CYP3A4HPGDCA2
SCHEMBL27646662 0.86 TSHR (0.59) TSHRALDH1A1CYP3A4HPGDCA2
SCHEMBL29448443 0.84 TSHR (0.56) TSHRALDH1A1CYP3A4HPGDMAPK1
SCHEMBL22561250 0.84 TSHR (0.57) TSHRALDH1A1CYP3A4HPGDCA2
SCHEMBL29507133 0.83 TSHR (0.55) TSHRALDH1A1CYP3A4HPGDMAPK1
SCHEMBL8995166 0.83 TSHR (0.55) TSHRALDH1A1CYP3A4HPGDTP53

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
EP-2935495-B1 PRESSURE-SENSITIVE ADHESIVES PREPARED FROM DEGRADABLE MONOMERS AND POLYMERS 3M INNOVATIVE PROPERTIES CO (US) 2019-10-09 EP disclosed
US-9334428-B2 Pressure-sensitive adhesives prepared from degradable monomers and polymers 3M INNOVATIVE PROPERTIES COMPANY (US) 2016-05-10 US disclosed
US-20150337179-A1 PRESSURE-SENSITIVE ADHESIVES PREPARED FROM DEGRADABLE MONOMERS AND POLYMERS 3M INNOVATIVE PROPERTIES COMPANY 2015-11-26 US disclosed
EP-2935495-A1 PRESSURE-SENSITIVE ADHESIVES PREPARED FROM DEGRADABLE MONOMERS AND POLYMERS 3M Innovative Properties Company (US) 2015-10-28 EP disclosed
WO-2014099300-A1 PRESSURE-SENSITIVE ADHESIVES PREPARED FROM DEGRADABLE MONOMERS AND POLYMERS 3M INNOVATIVE PROPERTIES COMPANY (US) 2014-06-26 WO disclosed
EP-0704509-B1 Pressure-sensitive adhesive composition and pressure-sensitive adhesive sheets using the composition NITTO DENKO CORP (JP) 1998-12-16 EP disclosed