SCHEMBL7633381

SCHEMBL7633381

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

nearest known ligand 0.42

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CA2 P00918 7/20 0.42
MAPK1 P28482 1/20 0.42
ACE2 Q9BYF1 1/20 0.42
MAPT P10636 1/20 0.38
CA1 P00915 4/20 0.37
SLC1A3 P43003 1/20 0.37
SLC1A2 P43004 1/20 0.37
SLC1A1 P43005 1/20 0.37
CTSK P43235 3/20 0.35
PDF Q9HBH1 1/20 0.34
GPR84 Q9NQS5 3/20 0.33
CTSS P25774 1/20 0.33
FFAR1 O14842 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
SCHEMBL5597137 0.79 CA2 (0.44) CA2MAPK1ACE2MAPTCA1
SCHEMBL22181671 0.74 ACE2 (0.55) CA2ACE2MAPTCA1GPR84
SCHEMBL11078481 0.74 FFAR1 (0.44) CA2MAPK1ACE2MAPTCA1
Lactic Acid SCHEMBL5613952 0.74 CA2 (0.43) CA2MAPK1ACE2MAPTCA1
SCHEMBL17560001 0.73 ACE2 (0.53) CA2ACE2MAPTCA1GPR84
SCHEMBL27620477 0.73 ACE2 (0.49) CA2ACE2MAPTCA1SLC1A2
SCHEMBL1784692 0.72 CA2 (0.39) CA2MAPK1ACE2MAPTCA1
SCHEMBL3999893 0.71 CA2 (0.40) CA2MAPK1ACE2MAPTCA1
SCHEMBL3999901 0.71 CA2 (0.40) CA2MAPK1ACE2MAPTCA1
SCHEMBL27601909 0.71 ACE2 (0.51) CA2ACE2MAPTCA1SLC1A2

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
US-6337374-B1 ETHYLENE-VINYL ACETATE COPOLYMER OR ETHYLENE-ALKYL METHACRYLATE COPOLYMER, POLYOLEFIN, CURING AND BUTYL METHACRYLATE THE GOODYEAR TIRE & RUBBER COMPANY 2002-01-08 US disclosed
US-20010006997-A1 Polymer blend having good physical properties THE GOODYEAR TIRE & RUBBER COMPANY 2001-07-05 US disclosed