SCHEMBL166492

SCHEMBL166492

C=CC(=O)NCCC(=C)C(=O)O

nearest known ligand 0.54

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.54
ALDH1A1 P00352 1/20 0.54
MAPK1 P28482 1/20 0.54
TDP1 Q9NUW8 1/20 0.54
ALOX15 P16050 1/20 0.47
HSD17B10 Q99714 1/20 0.47
ZDHHC20 Q5W0Z9 1/20 0.46
ZDHHC2 Q9UIJ5 1/20 0.46
TGM2 P21980 6/20 0.36
GAA P10253 1/20 0.33
LMNA P02545 1/20 0.31
TET2 Q6N021 3/20 0.30
TET3 O43151 1/20 0.30
TET1 Q8NFU7 1/20 0.30

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
SCHEMBL22721386 0.82 TSHR (0.46) TSHRALDH1A1MAPK1TDP1ALOX15
SCHEMBL35714 0.80 TSHR (0.54) TSHRALDH1A1MAPK1TDP1ALOX15
SCHEMBL257206 0.78 TSHR (0.52) TSHRALDH1A1MAPK1TDP1ALOX15
SCHEMBL28938243 0.78 TSHR (0.58) TSHRALDH1A1MAPK1TDP1ALOX15
SCHEMBL8653544 0.77 ZDHHC20 (0.45) TSHRALDH1A1MAPK1TDP1ALOX15
SCHEMBL167051 0.77 TSHR (0.68) TSHRALDH1A1MAPK1TDP1ALOX15
SCHEMBL10952688 0.77 TSHR (0.68) TSHRALDH1A1MAPK1TDP1ALOX15
SCHEMBL1525196 0.76 ZDHHC20 (0.47) TSHRALDH1A1MAPK1TDP1ZDHHC20
SCHEMBL22675564 0.76 TSHR (0.54) TSHRALDH1A1MAPK1TDP1ZDHHC20
SCHEMBL8461710 0.75 ALDH1A1 (0.84) TSHRALDH1A1MAPK1TDP1ALOX15

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3283538-A1 PULVERULENT MIXTURES CONTAINING LOW-EMISSION NITRILE RUBBERS ARLANXEO Deutschland GmbH (DE) 2018-02-21 EP claimed
WO-2016166063-A1 PULVERULENT MIXTURES CONTAINING LOW-EMISSION NITRILE RUBBERS ARLANXEO DEUTSCHLAND GMBH (DE) 2016-10-20 WO claimed
WO-2016124342-A1 COMPOSITIONS CONTAINING NBR-BASED MICROGELS ARLANXEO DEUTSCHLAND GMBH (DE) 2016-08-11 WO claimed
EP-3053938-A1 Compositions containing NBR-based microgels LANXESS Deutschland GmbH (DE) 2016-08-10 EP claimed
JP-63258607-A None JP disclosed
EP-3090017-B1 HYDROGENATED NITRILE RUBBERS CONTAINING PHENOL ARLANXEO DEUTSCHLAND GMBH (DE) 2020-07-15 EP disclosed
CN-107466301-B Pulverulent mixture containing low-emission nitrile rubber 阿朗新科德国有限责任公司 2020-05-29 CN disclosed
EP-3090001-B1 HYDROGENATED NITRILE RUBBER CONTAINING PHOSPHINE OR DIPHOSPHANE SULFIDE ARLANXEO DEUTSCHLAND GMBH (DE) 2019-10-09 EP disclosed
EP-3090000-B1 HYDROGENATED NITRILE RUBBER CONTAINING PHOSPHINE OR DIPHOSPHANE OXIDE ARLANXEO DEUTSCHLAND GMBH (DE) 2019-10-02 EP disclosed
EP-3090002-B1 HYDROGENATED NITRILE RUBBER CONTAINING PHOSPHINE OR DIPHOSPHANE OXIDE ARLANXEO DEUTSCHLAND GMBH (DE) 2019-10-02 EP disclosed
EP-3283538-B1 POWDER FORM MIXTURES CONTAINING LOW-EMISSION NITRILE RUBBERS ARLANXEO DEUTSCHLAND GMBH (DE) 2019-06-19 EP disclosed
EP-2658908-B1 VULCANISABLE COMPOUNDS BASED ON NITRILE RUBBERS CONTAINING EPOXY GROUPS ARLANXEO DEUTSCHLAND GMBH (DE) 2018-09-19 EP disclosed
EP-0361351-B1 Application of a painted film to a three-dimensional object CIBA GEIGY AG (CH) 1996-04-03 EP disclosed
EP-0304886-B1 Oligomer benzil ketals and their use as photoinitiators CIBA GEIGY AG (CH) 1993-12-08 EP disclosed
EP-0269573-B1 LIQUID PHOTOINITIATING MIXTURE CIBA-GEIGY AG (CH) 1991-03-27 EP disclosed
EP-0242330-B1 LIQUID BLEND OF PHOTOINITIATORS CIBA-GEIGY AG (CH) 1990-05-16 EP disclosed
EP-0361351-A2 Application of a painted film to a three-dimensional object CIBA-GEIGY AG (CH) 1990-04-04 EP disclosed
JP-S63258607-A FLOCCULANT EBARA INFILCO CO LTD 1988-10-26 JP disclosed
EP-0269573-A2 Liquid photoinitiating mixture CIBA-GEIGY AG (CH) 1988-06-01 EP disclosed
EP-0242330-A1 Liquid blend of photoinitiators CIBA-GEIGY AG (CH) 1987-10-21 EP disclosed