SCHEMBL729516

SCHEMBL729516

C=CC(=O)OCC(CCCC)CCCCCCCC

nearest known ligand 0.79

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
TSHR P16473 6/20 0.79
HPGD P15428 1/20 0.53
CYP3A4 P08684 3/20 0.46
TDP1 Q9NUW8 2/20 0.46
ATM Q13315 2/20 0.46
PRSS1 P07477 1/20 0.46
PRSS2 P07478 1/20 0.46
PRSS3 P35030 1/20 0.46
ALDH1A1 P00352 2/20 0.44
LMNA P02545 1/20 0.41
ZDHHC7 Q9NXF8 1/20 0.41
CA2 P00918 2/20 0.41
HCAR2 Q8TDS4 1/20 0.40
MAPT P10636 1/20 0.40
RECQL P46063 1/20 0.39
THRB P10828 2/20 0.39
ZDHHC20 Q5W0Z9 1/20 0.39
ZDHHC2 Q9UIJ5 1/20 0.39
THRA P10827 1/20 0.38

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
SCHEMBL31661155 1.00 TSHR (0.79) TSHRHPGDCYP3A4TDP1ATM
SCHEMBL729740 1.00 TSHR (0.79) TSHRHPGDCYP3A4TDP1ATM
SCHEMBL31448301 1.00 TSHR (0.79) TSHRHPGDCYP3A4TDP1ATM
SCHEMBL31661158 0.98 TSHR (0.81) TSHRHPGDCYP3A4TDP1ATM
SCHEMBL729433 0.98 TSHR (0.76) TSHRHPGDCYP3A4TDP1ATM
SCHEMBL1897662 0.98 TSHR (0.76) TSHRHPGDCYP3A4TDP1ATM
SCHEMBL729461 0.98 TSHR (0.76) TSHRHPGDCYP3A4TDP1ATM
SCHEMBL729056 0.98 TSHR (0.76) TSHRHPGDCYP3A4TDP1ATM
SCHEMBL17851227 0.98 TSHR (0.76) TSHRHPGDCYP3A4TDP1ATM
SCHEMBL17851220 0.98 TSHR (0.76) TSHRHPGDCYP3A4TDP1ATM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-107109138-B Water-based pressure sensitive adhesive composition 3M创新有限公司 2020-07-24 CN disclosed
EP-3240847-B1 WATER-BASED PRESSURE-SENSITIVE ADHESIVE COMPOSITIONS 3M INNOVATIVE PROPERTIES CO (US) 2020-04-29 EP disclosed
US-10414954-B2 Water-based pressure-sensitive adhesive compositions 3M INNOVATIVE PROPERTIES COMPANY (US) 2019-09-17 US disclosed
EP-3240852-B1 WATER-BASED PRESSURE-SENSITIVE ADHESIVE COMPOSITIONS 3M INNOVATIVE PROPERTIES CO (US) 2019-04-17 EP disclosed
EP-3240811-B1 WATER-BASED PRESSURE-SENSITIVE ADHESIVE COMPOSITIONS 3M INNOVATIVE PROPERTIES CO (US) 2018-11-28 EP disclosed
US-10081745-B1 Water-based pressure-sensitive adhesive compositions 3M INNOVATIVE PROPERTIES COMPANY (US) 2018-09-25 US disclosed
US-20180265754-A1 WATER-BASED PRESSURE-SENSITIVE ADHESIVE COMPOSITIONS 3M INNOVATIVE PROPERTIES COMPANY 2018-09-20 US disclosed
US-9890301-B2 Water-based pressure-sensitive adhesive compositions 3M INNOVATIVE PROPERTIES COMPANY (US) 2018-02-13 US disclosed
US-20170369749-A1 WATER-BASED PRESSURE-SENSITIVE ADHESIVE COMPOSITIONS 3M INNOVATIVE PROPERTIES COMPANY 2017-12-28 US disclosed
US-20170362467-A1 WATER-BASED PRESSURE-SENSITIVE ADHESIVE COMPOSITIONS 3M INNOVATIVE PROPERTIES COMPANY 2017-12-21 US disclosed
EP-3240811-A1 WATER-BASED PRESSURE-SENSITIVE ADHESIVE COMPOSITIONS 3M Innovative Properties Company (US) 2017-11-08 EP disclosed
EP-3240852-A1 WATER-BASED PRESSURE-SENSITIVE ADHESIVE COMPOSITIONS 3M Innovative Properties Company (US) 2017-11-08 EP disclosed
EP-3240847-A1 WATER-BASED PRESSURE-SENSITIVE ADHESIVE COMPOSITIONS 3M Innovative Properties Company (US) 2017-11-08 EP disclosed
WO-2016109174-A1 WATER-BASED PRESSURE-SENSITIVE ADHESIVE COMPOSITIONS 3M INNOVATIVE PROPERTIES COMPANY (US) 2016-07-07 WO disclosed
WO-2016109176-A1 WATER-BASED PRESSURE-SENSITIVE ADHESIVE COMPOSITIONS 3M INNOVATIVE PROPERTIES COMPANY (US) 2016-07-07 WO disclosed
WO-2016109173-A1 WATER-BASED PRESSURE-SENSITIVE ADHESIVE COMPOSITIONS 3M INNOVATIVE PROPERTIES COMPANY (US) 2016-07-07 WO disclosed
EP-2553032-B1 PRESSURE-SENSITIVE ADHESIVES DERIVED FROM 2-ALKYL ALKANOLS 3M INNOVATIVE PROPERTIES CO (US) 2014-04-23 EP disclosed
US-8137807-B2 Pressure-sensitive adhesives derived from 2-alkyl alkanols 3M INNOVATIVE PROPERTIES COMPANY (US) 2012-03-20 US disclosed
US-20110237725-A1 PRESSURE-SENSITIVE ADHESIVES DERIVED FROM 2-ALKYL ALKANOLS 3M INNOVATIVE PROPERTIES COMPANY 2011-09-29 US disclosed