SCHEMBL474840

SCHEMBL474840

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

nearest known ligand 0.39

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TRPA1 O75762 1/20 0.38
PTGS1 P23219 1/20 0.34
AKR1C3 P42330 1/20 0.34
CD81 P60033 1/20 0.34
ALDH1A1 P00352 3/20 0.33
LMNA P02545 1/20 0.33
SLC15A2 Q16348 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
FFAR3 O14843 1/20 0.32
LCK P06239 1/20 0.32
FYN P06241 1/20 0.32
CYP2C9 P11712 1/20 0.31
CYP2D6 P10635 1/20 0.30
ALOX15 P16050 1/20 0.30
GRIK2 Q13002 1/20 0.30
PPARG P37231 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
SCHEMBL474842 1.00 TRPA1 (0.38) TRPA1PTGS1AKR1C3CD81ALDH1A1
Acetone SCHEMBL5520081 0.97 TRPA1 (0.36) TRPA1PTGS1AKR1C3CD81ALDH1A1
SCHEMBL7138870 0.83 ALDH1A1 (0.43) TRPA1PTGS1AKR1C3CD81ALDH1A1
SCHEMBL275071 0.83 ALDH1A1 (0.43) TRPA1PTGS1AKR1C3CD81ALDH1A1
SCHEMBL2727259 0.83 ALDH1A1 (0.43) TRPA1PTGS1AKR1C3CD81ALDH1A1
SCHEMBL1623651 0.81 ALDH1A1 (0.41) TRPA1PTGS1AKR1C3CD81ALDH1A1
SCHEMBL1621314 0.81 ALDH1A1 (0.41) TRPA1PTGS1AKR1C3CD81ALDH1A1
SCHEMBL1622643 0.81 ALDH1A1 (0.41) TRPA1PTGS1AKR1C3CD81ALDH1A1
SCHEMBL3683286 0.80 KDM4E (0.43) TRPA1PTGS1AKR1C3CD81CYP2C9
SCHEMBL3683290 0.80 KDM4E (0.43) TRPA1PTGS1AKR1C3CD81CYP2C9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1753847-B1 LUBRICATING GREASE HAVING A HIGH WATER-RESISTANCE EVONIK OIL ADDITIVES GMBH (DE) 2018-05-23 EP disclosed
EP-1235870-B1 BLOCK COPOLYMERS AND METHOD FOR THE PRODUCTION AND UTILIZATION THEREOF EVONIK OIL ADDITIVES GMBH (DE) 2017-05-24 EP disclosed
EP-2411426-B1 (METH)ACRYLATE POLYMERS AND THE USE THEREOF AS POLYMER-BOUND UV INITIATORS OR ADDITIVE TO UV-CURABLE RESINS EVONIK ROEHM GMBH (DE) 2016-08-17 EP disclosed
EP-2411466-B1 COMPOSITION COMPRISING AS THE AQUEOUS DISPERSION PREFERABLY (METH)ACRYLATE POLYMERS CONTAINING BENZOPHENONE IN A MIXTURE WITH (METH)ACRYLATE POLYMERS DIFFERENT THEREFROM AND THE USE OF SAID COMPOSITION EVONIK ROEHM GMBH (DE) 2013-07-17 EP disclosed
EP-2344554-B1 COPOLYMER FOR PRODUCING MOLDED BODIES THAT ARE DIMENSIONALLY STABLE UNDER HEAT FROM MOLDING COMPOUNDS OR CAST GLASS EVONIK ROEHM GMBH (DE) 2012-12-05 EP disclosed
EP-1776390-B1 METHOD FOR RADICAL POLYMERIZATION OF ETHYLENICALLY UNSATURATED COMPOUNDS EVONIK ROHMAX ADDITIVES GMBH (DE) 2012-06-13 EP disclosed
EP-2411426-A1 (METH)ACRYLATE POLYMERS AND THE USE THEREOF AS POLYMER-BOUND UV INITIATORS OR ADDITIVE TO UV-CURABLE RESINS Evonik Röhm GmbH (DE) 2012-02-01 EP disclosed
EP-2411466-A1 COMPOSITION COMPRISING AS THE AQUEOUS DISPERSION PREFERABLY (METH)ACRYLATE POLYMERS CONTAINING BENZOPHENONE IN A MIXTURE WITH (METH)ACRYLATE POLYMERS DIFFERENT THEREFROM AND THE USE OF SAID COMPOSITION Evonik Röhm GmbH (DE) 2012-02-01 EP disclosed
EP-2376609-A1 FUEL COMPOSITIONS HAVING IMPROVED CLOUD POINT AND IMPROVED STORAGE PROPERTIES Evonik RohMax Additives GmbH (DE) 2011-10-19 EP disclosed
EP-2344554-A1 COPOLYMER FOR PRODUCING MOLDED BODIES THAT ARE DIMENSIONALLY STABLE UNDER HEAT FROM MOLDING COMPOUNDS OR CAST GLASS Evonik Röhm GmbH (DE) 2011-07-20 EP disclosed
EP-1240218-A1 GRADIENT COPOLYMERS AND METHOD FOR THE PRODUCTION THEREOF AND THEIR USE Rohmax Additives GmbH (DE) 2002-09-18 EP disclosed
EP-1240219-A1 COPOLYMERS WHICH CAN BE OBTAINED USING ATRP METHODS, AND METHOD FOR PRODUCING AND USING THE SAME Rohmax Additives GmbH (DE) 2002-09-18 EP disclosed
EP-1235870-A1 BLOCK COPOLYMERS AND METHOD FOR THE PRODUCTION AND UTILIZATION THEREOF Rohmax Additives GmbH (DE) 2002-09-04 EP disclosed
WO-2002038618-A2 METHOD FOR THE CONTINUOUS PRODUCTION OF POLYMER COMPOSITIONS AND THE USE THEREOF ROHMAX ADDITIVES GMBH (DE) 2002-05-16 WO disclosed
WO-2001051576-A1 ACRYLIC ADHESIVE COMPOSITIONS CONTAINING KETONYL (METH)ACRYLATE LOCTITE (R & D) LIMITED (IE) 2001-07-19 WO disclosed
WO-2001040339-A1 BLOCK COPOLYMERS AND METHOD FOR THE PRODUCTION AND UTILIZATION THEREOF ROHMAX ADDITIVES GMBH (DE) 2001-06-07 WO disclosed
WO-2001040334-A1 COPOLYMERS WHICH CAN BE OBTAINED USING ATRP METHODS, AND METHOD FOR PRODUCING AND USING THE SAME ROHMAX ADDITIVES GMBH (DE) 2001-06-07 WO disclosed
WO-2001040328-A1 METHOD FOR PRODUCING A COMPOSITION THAT CONTAINS POLYMER ESTER COMPOUNDS WITH LONG-CHAIN ALKYL GROUPS, AND USE OF SUCH A COMPOSITION ROHMAX ADDITIVES GMBH (DE) 2001-06-07 WO disclosed
WO-2001040333-A1 GRADIENT COPOLYMERS AND METHOD FOR THE PRODUCTION THEREOF AND THEIR USE ROHMAX ADDITIVES GMBH (DE) 2001-06-07 WO disclosed
EP-0965619-A1 Low odor, cold curable, (Meth)acylate reactive resin for floor coating, such réactive resin and the process for producing such floorcoating RÖHM GMBH (DE) 1999-12-22 EP disclosed