SCHEMBL888269

SCHEMBL888269

CCCCC(C)CC(COCC)C(=O)OC

nearest known ligand 0.53

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CA2 P00918 4/20 0.53
CA1 P00915 3/20 0.53
ZDHHC7 Q9NXF8 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
TSHR P16473 3/20 0.36
BIRC2 Q13490 4/20 0.36
ABCB1 P08183 1/20 0.35
CYP3A4 P08684 1/20 0.34
ATM Q13315 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
PLA2G2C Q5R387 1/20 0.34
MAPT P10636 1/20 0.34
HSD17B10 Q99714 1/20 0.34
ACE2 Q9BYF1 1/20 0.33
MAPK1 P28482 1/20 0.33
SLC1A3 P43003 1/20 0.33
SLC1A2 P43004 1/20 0.33
SLC1A1 P43005 1/20 0.33

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
SCHEMBL888537 0.89 CA2 (0.39) CA2CA1L3MBTL1TSHRCYP3A4
SCHEMBL888504 0.87 CA2 (0.56) CA2CA1ZDHHC7L3MBTL1TSHR
SCHEMBL820482 0.83 L3MBTL1 (0.37) CA2CA1L3MBTL1TSHRCYP3A4
SCHEMBL819562 0.80 MME (0.44) CA2CA1TSHRBIRC2SLC1A3
SCHEMBL888406 0.79 CA2 (0.42) CA2CA1ZDHHC7L3MBTL1TSHR
SCHEMBL888442 0.78 CA1 (0.43) CA2CA1ZDHHC7L3MBTL1TSHR
SCHEMBL888390 0.77 CA1 (0.38) CA2CA1TSHRBIRC2MAPT
SCHEMBL2943135 0.74 CA1 (0.53) CA2CA1ZDHHC7TSHRBIRC2
SCHEMBL8950290 0.73 CA2 (0.83) CA2CA1ZDHHC7TSHRBIRC2
SCHEMBL5610391 0.73 CA2 (0.48) CA2CA1L3MBTL1TSHRCYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110269928-A1 PROCESS FOR PRODUCING SOLID CATALYST COMPONENT FOR OLEFIN POLYMERIZATION SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2011-11-03 US disclosed