SCHEMBL1644507

SCHEMBL1644507

CC=C(CC=CO)C(=O)O

nearest known ligand 0.40

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
GRIK1 P39086 2/20 0.40
GRIK2 Q13002 2/20 0.40
ALDH1A1 P00352 1/20 0.33
CYP2D6 P10635 1/20 0.33
ALOX15 P16050 1/20 0.33
KDM4E B2RXH2 1/20 0.31
TSHR P16473 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
SCHEMBL11135326 0.82 GRIK1 (0.41) GRIK1GRIK2ALDH1A1CYP2D6ALOX15
SCHEMBL17258212 0.78 GRIK1 (0.39) GRIK1GRIK2ALDH1A1CYP2D6ALOX15
SCHEMBL19475551 0.78 ALDH1A1 (0.39) GRIK1GRIK2ALDH1A1CYP2D6ALOX15
SCHEMBL8664480 0.78 TSHR (0.50) ALDH1A1CYP2D6ALOX15KDM4ETSHR
SCHEMBL8570768 0.78 ABAT (0.32) GRIK1GRIK2ALDH1A1CYP2D6ALOX15
SCHEMBL19475550 0.78 ALDH1A1 (0.39) GRIK1GRIK2ALDH1A1CYP2D6ALOX15
SCHEMBL4687183 0.78 GRIK1 (0.30) GRIK1GRIK2
SCHEMBL11080413 0.75 GRIK1 (0.36) GRIK1GRIK2
SCHEMBL11080418 0.75 GRIK1 (0.36) GRIK1GRIK2
SCHEMBL29016742 0.75 GRIK1 (0.39) GRIK1GRIK2ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0694578-B1 Aqueous synthetic resin dispersion HOECHST AG (DE) 1999-09-29 EP claimed
EP-0694578-A2 Aqueous synthetic resin dispersion HOECHST AKTIENGESELLSCHAFT (DE) 1996-01-31 EP claimed
EP-3505523-A1 NEW RUBBER MIXTURES ARLANXEO Deutschland GmbH (DE) 2019-07-03 EP disclosed
EP-2812392-B1 BEARING SURFACE MIXTURE CONTAINING MICRO-GEL FOR WINTER TYRES ARLANXEO DEUTSCHLAND GMBH (DE) 2018-08-22 EP disclosed
EP-2812392-A1 MICROGEL-CONTAINING TREAD MIXTURE FOR WINTER TYRES Lanxess Deutschland GmbH (DE) 2014-12-17 EP disclosed
WO-2013117762-A1 MICROGEL-CONTAINING TREAD MIXTURE FOR WINTER TYRES LANXESS DEUTSCHLAND GMBH (DE) 2013-08-15 WO disclosed
EP-2626384-A1 Bearing surface mixture containing micro-gel for winter tyres Lanxess Deutschland GmbH (DE) 2013-08-14 EP disclosed
EP-2186651-B1 Hydroxyl modified microgel lattices which can be stored safely for a long time LANXESS DEUTSCHLAND GMBH (DE) 2013-07-03 EP disclosed
EP-2491077-A1 NOVEL RUBBER MIXTURES Lanxess Deutschland GmbH (DE) 2012-08-29 EP disclosed
WO-2011048034-A1 NOVEL RUBBER MIXTURES LANXESS DEUTSCHLAND GMBH (DE) 2011-04-28 WO disclosed
EP-2311907-A1 New rubber mixtures LANXESS Deutschland GmbH (DE) 2011-04-20 EP disclosed
EP-2186651-A1 Hydroxyl modified microgel lattices which can be stored safely for a long time Lanxess Deutschland GmbH (DE) 2010-05-19 EP disclosed
EP-0694578-B1 Aqueous synthetic resin dispersion HOECHST AG (DE) 1999-09-29 EP disclosed
EP-0694578-A2 Aqueous synthetic resin dispersion HOECHST AKTIENGESELLSCHAFT (DE) 1996-01-31 EP disclosed