SCHEMBL3249472

SCHEMBL3249472

C=CC(C=C(CCO)C(=O)O)C(=O)O

nearest known ligand 0.32

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
GRIK1 P39086 3/20 0.32
GRIA2 P42262 2/20 0.32
GRIA4 P48058 2/20 0.32
GRIK3 Q13003 2/20 0.32
GRIK5 Q16478 2/20 0.32
GRIK2 Q13002 2/20 0.32
GRIA1 P42261 1/20 0.32
SLC6A2 P23975 1/20 0.31
SLC6A4 P31645 1/20 0.31
BLM P54132 1/20 0.31
SLC6A3 Q01959 1/20 0.31
MEN1 O00255 1/20 0.31
CYP2D6 P10635 1/20 0.31
TSHR P16473 1/20 0.31
NFKB1 P19838 1/20 0.31
CYP2C19 P33261 1/20 0.31
KMT2A Q03164 1/20 0.31
OR51E2 Q9H255 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
SCHEMBL3249505 0.79 GRIK1 (0.39) GRIK1GRIA2GRIA4GRIK3GRIK5
SCHEMBL4654696 0.78 TSHR (0.45) GRIK1GRIA2GRIA4GRIK3GRIK5
SCHEMBL3240320 0.78 ALDH1A1 (0.39) GRIK1GRIA2GRIA4GRIK3GRIK5
SCHEMBL190183 0.69
SCHEMBL4524385 0.69 GRIK1 (0.33) GRIK1GRIA2GRIA4GRIK3GRIK5
SCHEMBL9264648 0.68 OR51E2 (0.33) SLC6A2SLC6A4BLMSLC6A3MEN1
SCHEMBL1135819 0.68 ALDH1A1 (0.32) GRIK1GRIA2GRIA4GRIK3GRIK5
SCHEMBL11065456 0.67 TSHR (0.39) SLC6A2SLC6A4BLMSLC6A3MEN1
SCHEMBL134750 0.67
SCHEMBL137012 0.67

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1957549-B1 POLYVINYLESTER SOLID RESINS HAVING HIGH POLYDISPERSITY WACKER CHEMIE AG (DE) 2010-05-19 EP claimed
EP-1957549-A2 POLYVINYLESTER AND POLY(METH)ACRYLATE SOLID RESINS HAVING HIGH POLYDISPERSITY Wacker Polymer Systems GmbH & Co. KG (DE) 2008-08-20 EP claimed
WO-2007065804-A2 POLYVINYLESTER AND POLY(METH)ACRYLATE SOLID RESINS HAVING HIGH POLYDISPERSITY WACKER POLYMER SYSTEMS GMBH & CO. KG (DE) 2007-06-14 WO claimed
EP-1957549-B1 POLYVINYLESTER SOLID RESINS HAVING HIGH POLYDISPERSITY WACKER CHEMIE AG (DE) 2010-05-19 EP disclosed
EP-1957549-A2 POLYVINYLESTER AND POLY(METH)ACRYLATE SOLID RESINS HAVING HIGH POLYDISPERSITY Wacker Polymer Systems GmbH & Co. KG (DE) 2008-08-20 EP disclosed
WO-2007065804-A2 POLYVINYLESTER AND POLY(METH)ACRYLATE SOLID RESINS HAVING HIGH POLYDISPERSITY WACKER POLYMER SYSTEMS GMBH & CO. KG (DE) 2007-06-14 WO disclosed
EP-1448671-A1 PRODUCTS, ESPECIALLY MOULDING MATERIALS OF POLYMERS CONTAINING TRIAZINE SEGMENTS, METHOD FOR THE PRODUCTION THEREOF AND USES OF THE SAME AMI Agrolinz Melamine International GmbH (AT) 2004-08-25 EP disclosed
WO-2003046053-A1 PRODUCTS, ESPECIALLY MOULDING MATERIALS OF POLYMERS CONTAINING TRIAZINE SEGMENTS, METHOD FOR THE PRODUCTION THEREOF AND USES OF THE SAME AMI - AGROLINZ MELAMINE INTERNATIONAL GMBH (AT) 2003-06-05 WO disclosed