SCHEMBL5052870

SCHEMBL5052870

CCCCCCCC(Br)C(Br)C(Br)C(Br)CCCCCCC(=O)OC

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ZDHHC7 Q9NXF8 1/20 0.57
PPARG P37231 2/20 0.48
L3MBTL1 Q9Y468 1/20 0.48
LMNA P02545 2/20 0.47
POLB P06746 1/20 0.46
POLA1 P09884 1/20 0.46
DGKA P23743 1/20 0.46
TSHR P16473 1/20 0.45
PPARA Q07869 1/20 0.45
MAPT P10636 2/20 0.45
MAPK1 P28482 1/20 0.45
LCK P06239 1/20 0.44
PPARD Q03181 1/20 0.44
ZDHHC20 Q5W0Z9 1/20 0.44
ZDHHC2 Q9UIJ5 1/20 0.44
CA12 O43570 1/20 0.44
CA2 P00918 1/20 0.44
CA7 P43166 1/20 0.44
CA9 Q16790 1/20 0.44
CA14 Q9ULX7 1/20 0.44

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
SCHEMBL4809286 0.90 ZDHHC7 (0.57) ZDHHC7PPARGL3MBTL1LMNAPOLB
SCHEMBL9860092 0.86 ZDHHC7 (0.56) ZDHHC7PPARGL3MBTL1LMNAPOLB
SCHEMBL11456570 0.86 ZDHHC7 (0.56) ZDHHC7PPARGL3MBTL1LMNAPOLB
SCHEMBL2834294 0.84 ZDHHC7 (0.50) ZDHHC7PPARGL3MBTL1LMNAPOLB
SCHEMBL18124155 0.83 ZDHHC7 (0.51) ZDHHC7PPARGL3MBTL1LMNAPOLB
SCHEMBL14947261 0.82 LMNA (0.53) ZDHHC7PPARGL3MBTL1LMNAPOLB
SCHEMBL14947259 0.82 LMNA (0.53) ZDHHC7PPARGL3MBTL1LMNAPOLB
SCHEMBL14231464 0.82 ZDHHC7 (0.51) ZDHHC7PPARGL3MBTL1LMNAPOLB
SCHEMBL5059441 0.82 ZDHHC7 (0.51) ZDHHC7PPARGL3MBTL1LMNAPOLB
SCHEMBL863540 0.82 TSHR (0.67) LMNAPOLBPOLA1DGKATSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2008048695-A2 SYNTHESIS AND APPLICATIONS OF NANOMATERIALS DERIVED FROM SELF-ASSEMBLED DIACETYLENIC TRIGLYCERIDES KANSAS STATE UNIVERSITY RESEARCH FOUNDATION (US) 2008-04-24 WO disclosed
WO-2008048695-A2 SYNTHESIS AND APPLICATIONS OF NANOMATERIALS DERIVED FROM SELF-ASSEMBLED DIACETYLENIC TRIGLYCERIDES KANSAS STATE UNIVERSITY RESEARCH FOUNDATION (US) 2008-04-24 WO disclosed