SCHEMBL3056482

SCHEMBL3056482

CC(=O)OCCC=C(C)C(=O)OC(C)=O

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 2/20 0.44
ALDH1A1 P00352 6/20 0.39
CHRM5 P08912 2/20 0.38
CHRM1 P11229 2/20 0.38
CHRM3 P20309 2/20 0.38
TSHR P16473 2/20 0.38
PGR P06401 1/20 0.38
CHRM2 P08172 1/20 0.38
CHRM4 P08173 1/20 0.38
HTR1A P08908 1/20 0.38
CHRNB2 P17787 1/20 0.38
TBXA2R P21731 1/20 0.38
CHRNB4 P30926 1/20 0.38
CHRNA3 P32297 1/20 0.38
CHRNA7 P36544 1/20 0.38
CHRNA4 P43681 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
CHRNA10 Q9GZZ6 1/20 0.38
CHRNA9 Q9UGM1 1/20 0.38
GALR3 O60755 2/20 0.36

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
SCHEMBL8773296 0.79 ALOX15 (0.47) ALOX15ALDH1A1CHRM5CHRM1CHRM3
SCHEMBL1696441 0.79 ALOX15 (0.47) ALOX15ALDH1A1CHRM5CHRM1CHRM3
SCHEMBL406199 0.79 ALOX15 (0.47) ALOX15ALDH1A1CHRM5CHRM1CHRM3
Acetic Acid SCHEMBL27340722 0.78 ALDH1A1 (0.41) ALDH1A1TSHRCYP2D6CYP2C19HSD17B10
SCHEMBL553240 0.78 ALOX15 (0.46) ALOX15ALDH1A1CHRM5CHRM1CHRM3
SCHEMBL553242 0.78 ALOX15 (0.46) ALOX15ALDH1A1CHRM5CHRM1CHRM3
SCHEMBL4740513 0.76 ALOX15 (0.68) ALOX15ALDH1A1CHRM5CHRM1CHRM3
SCHEMBL8865369 0.76 ALDH1A1 (0.39) ALDH1A1TSHRCYP2D6CYP2C19
SCHEMBL6238305 0.74 ALDH1A1 (0.33) ALDH1A1CHRM5CHRM1CHRM3TSHR
SCHEMBL27750363 0.74 EP300 (0.46) ALOX15ALDH1A1CYP2C19HSD17B10LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110072953-A Aqueous polymer composition 陶氏环球技术有限责任公司 2019-07-30 CN claimed
CN-109476794-A Prepare the method with the aqueous polymer dispersions of high chemical resistance 巴斯夫欧洲公司 2019-03-15 CN disclosed
CN-106478894-B High resiliency flocking adhesive 辽宁恒星精细化工有限公司 2018-09-07 CN disclosed
CN-106478894-A High resiliency flocking adhesive 辽宁恒星精细化工有限公司 2017-03-08 CN disclosed
CN-104204008-B Polymer, method and composition DSM IP ASSETS B.V. (NL) 2016-11-30 CN disclosed
CN-103459049-B Method of forming layered coating film and coated article 关西涂料株式会社 2016-08-17 CN disclosed
US-8497315-B2 Method for producing dispersions and use thereof AKZO NOBEL N.V. (NL) 2013-07-30 US disclosed
US-20100221418-A1 PAVING JOINT MORTARS STADTBAEUMER SIEGMUND KSIAZEK 2010-09-02 US disclosed
US-20100081736-A1 METHOD FOR PRODUCING DISPERSIONS AND USE THEREOF CELANESE SWITZERLAND AG (CH) 2010-04-01 US disclosed