SCHEMBL2230971

SCHEMBL2230971

CCCCCC(CC(CC)CCCC)C(=O)O

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA2 P00918 8/20 0.62
MAPK1 P28482 1/20 0.62
GRIK1 P39086 2/20 0.61
GRIK2 Q13002 2/20 0.61
SLC1A2 P43004 2/20 0.61
SLC1A1 P43005 2/20 0.61
SLC1A3 P43003 1/20 0.58
GPR84 Q9NQS5 3/20 0.46
CA1 P00915 3/20 0.46
FFAR1 O14842 1/20 0.46
ALDH1A1 P00352 1/20 0.45
MAPT P10636 1/20 0.44
LCK P06239 1/20 0.44
PPARD Q03181 1/20 0.44
ZDHHC20 Q5W0Z9 1/20 0.44
ZDHHC2 Q9UIJ5 1/20 0.44
CHRM1 P11229 1/20 0.43
AKR1A1 P14550 1/20 0.43
CHRM3 P20309 1/20 0.43
HTR2A P28223 1/20 0.43

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
SCHEMBL27584964 0.98 GRIK1 (0.62) CA2MAPK1GRIK1GRIK2SLC1A2
SCHEMBL6508633 0.98 GRIK1 (0.62) CA2MAPK1GRIK1GRIK2SLC1A2
SCHEMBL7766551 0.98 GRIK1 (0.62) CA2MAPK1GRIK1GRIK2SLC1A2
SCHEMBL1134730 0.98 GRIK1 (0.62) CA2MAPK1GRIK1GRIK2SLC1A2
SCHEMBL20918220 0.98 GRIK1 (0.62) CA2MAPK1GRIK1GRIK2SLC1A2
SCHEMBL9188141 0.98 GRIK1 (0.62) CA2MAPK1GRIK1GRIK2SLC1A2
SCHEMBL160551 0.98 GRIK1 (0.62) CA2MAPK1GRIK1GRIK2SLC1A2
SCHEMBL64421 0.98 GRIK1 (0.62) CA2MAPK1GRIK1GRIK2SLC1A2
SCHEMBL5493649 0.98 GRIK1 (0.62) CA2MAPK1GRIK1GRIK2SLC1A2
SCHEMBL121781 0.98 GRIK1 (0.62) CA2MAPK1GRIK1GRIK2SLC1A2

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
EP-2348833-A2 LIQUID AQUEOUS CROP PROTECTION FORMULATIONS BASF SE (DE) 2011-08-03 EP disclosed
EP-2346322-A2 LIQUID PYRACLOSTROBIN-CONTAINING CROP PROTECTION FORMULATIONS BASF SE (DE) 2011-07-27 EP disclosed
WO-2010040835-A2 LIQUID PYRACLOSTROBIN-CONTAINING CROP PROTECTION FORMULATIONS BASF SE (DE) 2010-04-15 WO disclosed
WO-2010040834-A2 LIQUID AQUEOUS CROP PROTECTION FORMULATIONS BASF SE (DE) 2010-04-15 WO disclosed