SCHEMBL2050898

SCHEMBL2050898

C=CCC1(C/C=C/CCCC)C(=O)CCCC1=O

nearest known ligand 0.37

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CPT1A P50416 1/20 0.37
ALDH1A1 P00352 1/20 0.34
TSHR P16473 1/20 0.34
FAAH O00519 3/20 0.34
MGLL Q99685 1/20 0.34
F7 P08709 1/20 0.30
F3 P13726 1/20 0.30
TRPV1 Q8NER1 1/20 0.30
PTPN1 P18031 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
SCHEMBL2050901 1.00 CPT1A (0.37) CPT1AALDH1A1TSHRFAAHMGLL
SCHEMBL2052188 0.95 FAAH (0.39) CPT1AALDH1A1TSHRFAAHMGLL
SCHEMBL2052192 0.95 FAAH (0.39) CPT1AALDH1A1TSHRFAAHMGLL
SCHEMBL2048415 0.94 CPT1A (0.41) CPT1AALDH1A1TSHRFAAHMGLL
SCHEMBL2049424 0.94 CPT1A (0.41) CPT1AALDH1A1TSHRFAAHMGLL
SCHEMBL2047368 0.94 CPT1A (0.41) CPT1AALDH1A1TSHRFAAHMGLL
SCHEMBL2048412 0.94 CPT1A (0.41) CPT1AALDH1A1TSHRFAAHMGLL
SCHEMBL2051202 0.94 CPT1A (0.41) CPT1AALDH1A1TSHRFAAHMGLL
SCHEMBL2051199 0.94 CPT1A (0.41) CPT1AALDH1A1TSHRFAAHMGLL
SCHEMBL2050275 0.94 CPT1A (0.41) CPT1AALDH1A1TSHRFAAHMGLL

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7964691-B2 5,5-diallyl-2,2-dimethyl-1,3-dioxane as monomer units; polymerization catalysts; heat resistance SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2011-06-21 US disclosed
WO-2009038031-A1 BLOCK COPOLYMER AND PRODUCTION PROCESS THEREOF SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2009-03-26 WO disclosed
US-20080221287-A1 DIENE POLYMER AND PROCESS FOR PRODUCING THE SAME SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2008-09-11 US disclosed
US-20080214755-A1 OLEFIN-DIENE COPOLYMER AND PROCESS FOR PRODUCING THE SAME SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2008-09-04 US disclosed