SCHEMBL629110

SCHEMBL629110

C=C(CCC)C(=O)OC(=O)O

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.42
FFAR3 O14843 4/20 0.40
HDAC3 O15379 4/20 0.40
HDAC1 Q13547 4/20 0.40
HDAC2 Q92769 4/20 0.40
HDAC8 Q9BY41 4/20 0.40
CES2 O00748 1/20 0.36
CES1 P23141 1/20 0.36
TSHR P16473 6/20 0.33
AKR1B1 P15121 1/20 0.31
HDAC6 Q9UBN7 1/20 0.31
PPARG P37231 5/20 0.30
PPARD Q03181 5/20 0.30
PPARA Q07869 5/20 0.30
HDAC11 Q96DB2 4/20 0.30
GPR84 Q9NQS5 3/20 0.30
TLR2 O60603 2/20 0.30
TDP1 Q9NUW8 2/20 0.30
FABP4 P15090 2/20 0.30
PTPN1 P18031 2/20 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
SCHEMBL26121447 0.87 CES1 (0.41) ALDH1A1CES2CES1TSHRAKR1B1
SCHEMBL2522297 0.85 AKR1B1 (0.46) ALDH1A1CES2CES1TSHRAKR1B1
SCHEMBL9245458 0.84 ALDH1A1 (0.41) ALDH1A1FFAR3HDAC3HDAC1HDAC2
SCHEMBL10527328 0.84 ALDH1A1 (0.44) ALDH1A1FFAR3HDAC3HDAC1HDAC2
SCHEMBL9950815 0.84 GPR84 (0.48) ALDH1A1CES2CES1TSHRAKR1B1
SCHEMBL375255 0.83 FFAR3 (0.38) ALDH1A1FFAR3TSHRTDP1MEN1
Acetic Acid SCHEMBL27838110 0.83 HSD17B10 (0.41) ALDH1A1FFAR3HDAC3HDAC1HDAC2
SCHEMBL8360661 0.82 HSD17B10 (0.44) ALDH1A1FFAR3HDAC3HDAC1HDAC2
SCHEMBL28873666 0.81 FFAR3 (0.36) ALDH1A1FFAR3TSHRTDP1MEN1
SCHEMBL6896365 0.80 ALDH1A1 (0.41) ALDH1A1FFAR3HDAC3HDAC1HDAC2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20160032118-A1 Printing Process FUJIFILM IMAGING COLORANTS, INC. 2016-02-04 US disclosed
US-20140141262-A1 VINYL ALCOHOL POLYMERS WITH SILANE SIDE CHAINS AND COMPOSITIONS COMPRISING THE SAME SUN CHEMICAL CORPORATION (US) 2014-05-22 US disclosed
US-20140066557-A1 PRESSURE-SENSITIVE ADHESIVE COMPOSITION AND PRESSURE-SENSITIVE ADHESIVE SHEET NITTO DENKO CORPORATION (JP) 2014-03-06 US disclosed
US-8603630-B2 Radiation-curable adhesive composition and adhesive sheet NITTO DENKO CORPORATION (JP) 2013-12-10 US disclosed
EP-2357214-B1 Coating and method for particle reduction 3M INNOVATIVE PROPERTIES CO (US) 2013-01-23 EP disclosed
US-20120165471-A1 RADIATION-CURABLE ADHESIVE COMPOSITION AND ADHESIVE SHEET NITTO DENKO CORPORATION (JP) 2012-06-28 US disclosed
US-20120165489-A1 RADIATION-CURABLE ADHESIVE COMPOSITION AND ADHESIVE SHEET NITTO DENKO CORPORATION (JP) 2012-06-28 US disclosed
EP-2231798-B1 Coatings for particle reduction 3M INNOVATIVE PROPERTIES CO (US) 2012-02-22 EP disclosed
EP-2357214-A1 Coating and method for particle reduction 3M Innovative Properties Company (US) 2011-08-17 EP disclosed
US-7923133-B2 Coatings and methods for particle reduction 3M INNOVATIVE PROPERTIES COMPANY (US) 2011-04-12 US disclosed
EP-2231798-A1 COATINGS AND METHODS FOR PARTICLE REDUCTION 3M Innovative Properties Company (US) 2010-09-29 EP disclosed
WO-2009082599-A1 COATINGS AND METHODS FOR PARTICLE REDUCTION 3M INNOVATIVE PROPERTIES COMPANY (US) 2009-07-02 WO disclosed
US-20090162700-A1 COATINGS AND METHODS FOR PARTICLE REDUCTION 3M INNOVATIVE PROPERTIES COMPANY 2009-06-25 US disclosed