SCHEMBL4389988

SCHEMBL4389988

CC=CC=CCC=C(C)C(=O)O

nearest known ligand 0.34

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
GRIK2 Q13002 2/20 0.34
GRIK1 P39086 1/20 0.34
SOAT1 P35610 1/20 0.34
PTGS1 P23219 1/20 0.32
AKR1C3 P42330 1/20 0.32
CNR2 P34972 8/20 0.32
CNR1 P21554 6/20 0.32
PPARG P37231 1/20 0.32
PPARD Q03181 1/20 0.32
PPARA Q07869 1/20 0.32
TRPA1 O75762 1/20 0.30
TRPV1 Q8NER1 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
SCHEMBL4389981 1.00 GRIK2 (0.34) GRIK2GRIK1SOAT1PTGS1AKR1C3
SCHEMBL852778 0.85 AKR1C3 (0.35) GRIK2GRIK1PTGS1AKR1C3PPARG
SCHEMBL3126999 0.85 AKR1C3 (0.35) GRIK2GRIK1PTGS1AKR1C3PPARG
SCHEMBL700124 0.85 AKR1C3 (0.35) GRIK2GRIK1PTGS1AKR1C3PPARG
SCHEMBL9486198 0.82 AKR1C3 (0.39) GRIK2PTGS1AKR1C3PPARGPPARD
SCHEMBL9486204 0.82 AKR1C3 (0.39) GRIK2PTGS1AKR1C3PPARGPPARD
SCHEMBL18229916 0.77
SCHEMBL1774518 0.77 AKR1C3 (0.42) GRIK2PTGS1AKR1C3PPARGTRPA1
SCHEMBL1774515 0.77 AKR1C3 (0.42) GRIK2PTGS1AKR1C3PPARGTRPA1
SCHEMBL6972821 0.76 AKR1C3 (0.35) GRIK2PTGS1AKR1C3PPARG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3973934-B1 POLYCATIONIC POLYMER, COMPOSITION COMPRISING THE POLYCATIONIC POLYMER, AND PRODUCT, COMPRISING AN ACTIVE SURFACE, PROVIDED WITH THE POLYCATIONIC POLYMER COBATT (NL) 2023-12-20 EP claimed
EP-2454333-B1 AN AQUEOUS INK JET INK COMPRISING A CROSSLINKING PIGMENT DISPERSION BASED ON DIBLOCK POLYMERIC DISPERSANTS DU PONT (US) 2015-09-09 EP claimed
EP-1631635-B1 AQUEOUS IONICALLY STABILIZED DISPERSIONS DU PONT (US) 2009-12-02 EP claimed
EP-0851013-B1 Ink jet inks containing branched polymer dispersants and emulsion polymer additives DU PONT (US) 2003-05-28 EP claimed
EP-0851011-B1 Ink jet inks containing emulsion polymer additives stabilized with structured polymers DU PONT (US) 2002-05-22 EP claimed
EP-0518225-B2 Aqueous pigmented inks for ink jet printers DU PONT (US) 1999-10-20 EP claimed
EP-0633914-B1 An aqueous ink composition DU PONT (US) 1998-10-21 EP claimed
EP-0626977-B1 ABC TRIBLOCK METHACRYLATE POLYMERS DU PONT (US) 1997-07-09 EP claimed
EP-0565709-B1 AQUEOUS INK JET INKS CONTAINING POLYOL/ALKYLENE OXIDE CONDENSATES AS COSOLVENTS DU PONT (US) 1996-11-13 EP claimed
EP-0509109-B1 Aqueous pigmented inks for ink jet printers DU PONT (US) 1995-07-12 EP claimed
EP-0041396-B1 DIENYL METHACRYLATES E.I. DU PONT DE NEMOURS AND COMPANY (US) 1984-03-21 EP claimed
EP-3752571-A1 OIL BINDER SUMTEQ GmbH (DE) 2020-12-23 EP disclosed
WO-2019158642-A1 OIL BINDER SUMTEQ GMBH (DE) 2019-08-22 WO disclosed
EP-3299410-A1 PARTIALLY CROSS-LINKED POLYMER FOAM WITH CLOUDING AGENT SUMTEQ GmbH (DE) 2018-03-28 EP disclosed
EP-0041396-B1 DIENYL METHACRYLATES E.I. DU PONT DE NEMOURS AND COMPANY (US) 1984-03-21 EP disclosed