SCHEMBL8164036

SCHEMBL8164036

CCCCC(C)C(CC)(C(=O)O)C(=O)O

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA2 P00918 3/20 0.42
MAPK1 P28482 1/20 0.42
ACE2 Q9BYF1 1/20 0.37
POLB P06746 1/20 0.37
GPR84 Q9NQS5 3/20 0.36
CA1 P00915 3/20 0.36
FFAR1 O14842 1/20 0.36
SLC1A3 P43003 1/20 0.36
SLC1A2 P43004 1/20 0.36
SLC1A1 P43005 1/20 0.36
MAPT P10636 1/20 0.35
LCK P06239 1/20 0.35
PPARD Q03181 1/20 0.35
ZDHHC20 Q5W0Z9 1/20 0.35
ZDHHC2 Q9UIJ5 1/20 0.35
SLC15A1 P46059 1/20 0.35
HSPD1 P10809 1/20 0.35
BLM P54132 1/20 0.35
HSPE1 P61604 1/20 0.35
TSHR P16473 1/20 0.34

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
SCHEMBL7047972 0.94 ACE2 (0.44) ACE2GPR84CA1FFAR1SLC1A2
SCHEMBL19514773 0.87 CHRM1 (0.41) CA2MAPK1ACE2GPR84SLC1A3
SCHEMBL11336656 0.79 CA2 (0.42) CA2MAPK1ACE2GPR84CA1
SCHEMBL3640223 0.78 MEN1 (0.31) TSHR
SCHEMBL28791864 0.78 CA2 (0.45) CA2MAPK1GPR84CA1FFAR1
SCHEMBL28657658 0.77 CA2 (0.48) CA2MAPK1ACE2GPR84CA1
SCHEMBL3745224 0.77 CA2 (0.48) CA2MAPK1ACE2GPR84CA1
SCHEMBL13517878 0.76 CA2 (0.33) CA2MAPK1ACE2MAPT
Ammonia Solution, Strong SCHEMBL10585171 0.76 MEN1 (0.30) TSHR
SCHEMBL25269145 0.75 CA2 (0.47) CA2MAPK1ACE2GPR84CA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6071846-A OLEFIN POLYMERIZATION CATALYST WHICH ALLOWS A POLYOLEFIN TO HAVE HIGH STEREOREGULARITY AND HIGH POLYMERIZATION ACTIVITY; SOLID TITANIUM CATALYST COMPONENT COMPRISES A MAGNESIUM ATOM, TITANIUM ATOM, HALOGEN ATOM AND ELECTRON DONOR TOKUYAMA CORPORATION (JP) 2000-06-06 US disclosed
EP-0739907-B1 An olefin polymerization catalyst and a polyolefin production method TOKUYAMA CORP (JP) 1999-12-01 EP disclosed
EP-0739907-A1 An olefin polymerization catalyst and a polyolefin production method TOKUYAMA CORPORATION (JP) 1996-10-30 EP disclosed