SCHEMBL21044757

SCHEMBL21044757

CCCCCCCCCCCCCCCCCCCCCCCCCCOC(C)=O

nearest known ligand 0.81

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.81
NAAA Q02083 1/20 0.64
TSHR P16473 3/20 0.63
EPHX1 P07099 1/20 0.59
CES2 O00748 1/20 0.56
HCAR2 Q8TDS4 1/20 0.53
RAD52 P43351 1/20 0.53
NPSR1 Q6W5P4 1/20 0.53
DGKA P23743 1/20 0.52
ACHE P22303 6/20 0.52
FAAH O00519 1/20 0.52
LMNA P02545 1/20 0.52

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
Undecylacetate SCHEMBL1300652 1.00 ALDH1A1 (0.81) ALDH1A1NAAATSHREPHX1CES2
Dodecylacetate SCHEMBL159219 1.00 ALDH1A1 (0.81) ALDH1A1NAAATSHREPHX1CES2
Dodecylacetate SCHEMBL5185225 1.00 ALDH1A1 (0.81) ALDH1A1NAAATSHREPHX1CES2
Nonylacetate SCHEMBL115437 1.00 ALDH1A1 (0.81) ALDH1A1NAAATSHREPHX1CES2
Tridecylacetate SCHEMBL157239 1.00 ALDH1A1 (0.81) ALDH1A1NAAATSHREPHX1CES2
Nonylacetate SCHEMBL309051 1.00 ALDH1A1 (0.81) ALDH1A1NAAATSHREPHX1CES2
SCHEMBL131668 1.00 ALDH1A1 (0.81) ALDH1A1NAAATSHREPHX1CES2
Decylacetate SCHEMBL155855 1.00 ALDH1A1 (0.81) ALDH1A1NAAATSHREPHX1CES2
Octyl Acetate SCHEMBL4344544 1.00 ALDH1A1 (0.81) ALDH1A1NAAATSHREPHX1CES2
Nonylacetate SCHEMBL10804375 1.00 ALDH1A1 (0.81) ALDH1A1NAAATSHREPHX1CES2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115667599-B Heat storage composition 住友化学株式会社 2026-05-12 CN disclosed
EP-3492526-B1 RESIN COMPOSITION AND USE THEREOF SUMITOMO CHEMICAL CO (JP) 2025-02-19 EP disclosed
CN-117321172-A Heat storage composition 住友化学株式会社 2023-12-29 CN disclosed
US-20190270923-A1 RESIN COMPOSITION AND USE THEREOF SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2019-09-05 US disclosed
EP-3492526-A1 RESIN COMPOSITION AND USE THEREOF Sumitomo Chemical Company Limited (JP) 2019-06-05 EP disclosed
CN-106526040-B Differentiate the method for fresh cocoon/dried cocoon raw silk based on GC or GC-MS technologies 浙江理工大学 2018-09-07 CN disclosed
CN-106526040-A Method for identifying fresh cocoon/dried cocoon raw silk based on GC or GC-MS technology 浙江理工大学 2017-03-22 CN disclosed
CN-106526040-A Method for identifying fresh cocoon/dried cocoon raw silk based on GC or GC-MS technology 浙江理工大学 2017-03-22 CN disclosed
CN-102099364-B High purity monoalkyltin compounds and uses thereof ARKEMA FRANCE 2015-05-13 CN disclosed
CN-101443399-A Stabilizer composition for halogenated polymers with improved initial color and improved color retention BAERLOCHER GMBH (DE) 2009-05-27 CN disclosed