SCHEMBL1644504

SCHEMBL1644504

C=CC/C(C(=O)O)=C(\C)O

nearest known ligand 0.35

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.35
GRIK1 P39086 1/20 0.31
LMNA P02545 1/20 0.30
THRB P10828 1/20 0.30
FNTA P49354 1/20 0.30
FNTB P49356 1/20 0.30
PGGT1B P53609 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
SCHEMBL28268445 0.85 GRIK1 (0.40) ALDH1A1GRIK1LMNATHRBFNTA
SCHEMBL815174 0.84 LMNA (0.37) ALDH1A1LMNA
SCHEMBL3903875 0.84 LMNA (0.37) ALDH1A1LMNA
SCHEMBL815175 0.84 LMNA (0.37) ALDH1A1LMNA
SCHEMBL10901739 0.83 ALDH1A1 (0.33) ALDH1A1GRIK1
SCHEMBL11969997 0.83 FNTA (0.42) ALDH1A1GRIK1THRBFNTAFNTB
SCHEMBL1135817 0.83 FNTA (0.42) ALDH1A1GRIK1THRBFNTAFNTB
SCHEMBL2082246 0.83 FNTA (0.42) ALDH1A1GRIK1THRBFNTAFNTB
SCHEMBL4895896 0.81 ALDH1A1 (0.32) ALDH1A1
SCHEMBL17258210 0.81 ALDH1A1 (0.32) ALDH1A1

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