SCHEMBL15820652

SCHEMBL15820652

C=C(Cc1ccccc1)C(=O)OC(C)(O)C(=O)O

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.42
CES1 P23141 2/20 0.40
CES2 O00748 1/20 0.40
AKR1B1 P15121 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
ALDH1A1 P00352 1/20 0.38
MAPK1 P28482 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
PAM P19021 1/20 0.37
ADRB2 P07550 1/20 0.36
ADRB1 P08588 1/20 0.36
ADRB3 P13945 1/20 0.36
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
HDAC8 Q9BY41 1/20 0.36
HDAC6 Q9UBN7 1/20 0.36
CYP3A4 P08684 1/20 0.36
CYP2C9 P11712 1/20 0.36
NPC1 O15118 1/20 0.36
MAPT P10636 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
SCHEMBL4976027 0.85 CES1 (0.44) TSHRCES1CES2AKR1B1SMN1; SMN2
SCHEMBL2833902 0.79 CES1 (0.50) TSHRCES1CES2AKR1B1ALDH1A1
SCHEMBL28118587 0.76 CES2 (0.48) TSHRCES1CES2AKR1B1SMN1; SMN2
SCHEMBL1666500 0.76 CES2 (0.48) TSHRCES1CES2AKR1B1SMN1; SMN2
SCHEMBL28582716 0.76 CES1 (0.52) TSHRCES1CES2AKR1B1SMN1; SMN2
SCHEMBL8767243 0.74 CES1 (0.50) TSHRCES1CES2AKR1B1SMN1; SMN2
SCHEMBL28080747 0.74 ALDH1A1 (0.40) TSHRCES1CES2AKR1B1SMN1; SMN2
Hydrochloric Acid SCHEMBL28053659 0.73 CES2 (0.45) TSHRCES1CES2AKR1B1SMN1; SMN2
SCHEMBL394740 0.73 ALDH1A1 (0.56) TSHRCES1CES2AKR1B1SMN1; SMN2
SCHEMBL4623853 0.73 CES2 (0.45) TSHRCES1CES2AKR1B1SMN1; SMN2

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 7 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
CN-104870588-B The contact adhesive prepared by degradable monomer and polymer 3M INNOVATIVE PROPERTIES CO. (US) 2016-11-30 CN 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
CN-104870588-A Pressure-sensitive adhesives prepared from degradable monomers and polymers 3M INNOVATIVE PROPERTIES CO 2015-08-26 CN disclosed
WO-2014099300-A1 PRESSURE-SENSITIVE ADHESIVES PREPARED FROM DEGRADABLE MONOMERS AND POLYMERS 3M INNOVATIVE PROPERTIES COMPANY (US) 2014-06-26 WO disclosed