SCHEMBL1304584

SCHEMBL1304584

C=CC(=O)NC(C)OCC1CO1

nearest known ligand 0.44

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.44
ALDH1A1 P00352 4/20 0.40
TP53 P04637 1/20 0.33
CYP3A4 P08684 1/20 0.33
ACACB O00763 2/20 0.32
MAPK1 P28482 2/20 0.31
TDP1 Q9NUW8 1/20 0.31

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
SCHEMBL12081156 0.84 ALDH1A1 (0.37) TSHRALDH1A1TP53CYP3A4MAPK1
SCHEMBL1303579 0.83 ALDH1A1 (0.37) TSHRALDH1A1TP53CYP3A4ACACB
SCHEMBL1305178 0.81 ALDH1A1 (0.39) TSHRALDH1A1TDP1
SCHEMBL1304834 0.79 ALDH1A1 (0.50) ALDH1A1TP53CYP3A4
SCHEMBL29116834 0.78 ALDH1A1 (0.58) TSHRALDH1A1TP53CYP3A4MAPK1
SCHEMBL9200798 0.76 ALDH1A1 (0.32) TSHRALDH1A1ACACB
SCHEMBL1144470 0.75 ALDH1A1 (0.41) TSHRALDH1A1TP53CYP3A4MAPK1
SCHEMBL368428 0.73 TSHR (0.56) TSHRALDH1A1ACACBMAPK1TDP1
SCHEMBL10349740 0.73 ALDH1A1 (0.41) TSHRALDH1A1TP53CYP3A4MAPK1
SCHEMBL8760952 0.72 ALDH1A1 (0.38) TSHRALDH1A1TP53CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3510108-A1 WATERBORNE COPOLYMER DISPERSIONS WITH IMPROVED WET SCRUB RESISTANCE Celanese International Corporation (US) 2019-07-17 EP claimed
US-9920483-B2 Copolymer dispersions and their use in paper-coating formulations CELANESE SALES GERMANY GMBH (DE) 2018-03-20 US claimed
US-20180072912-A1 WATERBORNE COPOLYMER DISPERSIONS WITH IMPROVED WET SCRUB RESISTANCE CELANESE INTERNATIONAL CORPORATION 2018-03-15 US claimed
WO-2018049034-A1 WATERBORNE COPOLYMER DISPERSIONS WITH IMPROVED WET SCRUB RESISTANCE CELANESE INTERNATIONAL CORPORATION (US) 2018-03-15 WO claimed
US-20160153148-A1 COPOLYMER DISPERSIONS AND THEIR USE IN PAPER-COATING FORMULATIONS CELANESE EMULSIONS GMBH (DE) 2016-06-02 US claimed
EP-3011106-A2 COPOLYMER DISPERSIONS AND THEIR USE IN PAPER-COATING FORMULATIONS Celanese Sales Germany GmbH (DE) 2016-04-27 EP claimed
WO-2014204777-A2 COPOLYMER DISPERSIONS AND THEIR USE IN PAPER-COATING FORMULATIONS CELANESE EMULSIONS GMBH (DE) 2014-12-24 WO claimed
EP-3660214-B1 COPOLYMER DISPERSIONS AND THEIR USE IN PAPER-COATING FORMULATIONS CELANESE SALES GERMANY GMBH (DE) 2024-09-04 EP disclosed
EP-3660214-A1 COPOLYMER DISPERSIONS AND THEIR USE IN PAPER-COATING FORMULATIONS Celanese Sales Germany GmbH (DE) 2020-06-03 EP disclosed
US-9920483-B2 Copolymer dispersions and their use in paper-coating formulations CELANESE SALES GERMANY GMBH (DE) 2018-03-20 US disclosed
US-20180072912-A1 WATERBORNE COPOLYMER DISPERSIONS WITH IMPROVED WET SCRUB RESISTANCE CELANESE INTERNATIONAL CORPORATION 2018-03-15 US disclosed
US-9593180-B2 Cross-linkable monomers and polymers and the use thereof CELANESE EMULSIONS GMBH (DE) 2017-03-14 US disclosed
US-20160153148-A1 COPOLYMER DISPERSIONS AND THEIR USE IN PAPER-COATING FORMULATIONS CELANESE EMULSIONS GMBH (DE) 2016-06-02 US disclosed
US-20110287680-A1 Mineral wool fibber batting, method for the production thereof and use of same CELANESE EMULSIONS GMBH (DE) 2011-11-24 US disclosed
US-8053511-B2 Process for preparing polymer dispersions, the resulting dispersions and their use CELANESE EMULSIONS GMBH (DE) 2011-11-08 US disclosed
US-20110190462-A1 Cross-Linkable Monomers and Polymers and the Use Thereof CELANESE EMULSIONS GMBH (DE) 2011-08-04 US disclosed
US-20100256292-A1 CROSSLINKABLE POLYMER DISPERSIONS, COATING COMPOSITIONS COMPRISING THEM AND USE THEREOF CELANESE EMULSIONS GMBH (DE) 2010-10-07 US disclosed
US-20100179272-A1 Cross-Linkable Polymer Dispersions, Method for the Production Thereof and Use Thereof NUTRINOVA NUTRITION SPECIALTIES & FOOD INGREDIENTS GMBH (DE) 2010-07-15 US disclosed
US-20090312481-A1 POLYVINYL ESTER DISPERSIONS AND THEIR USE CELANESE EMULSIONS GMBH (DE) 2009-12-17 US disclosed
US-20090203832-A1 Process for Preparing Polymer Dispersions, the Resulting Dispersions and Their Use CELANESE EMULSIONS GMBH (DE) 2009-08-13 US disclosed