SCHEMBL487325

SCHEMBL487325

CCCCCCCCC(CCC(CCCCCCCC)C(=O)OC(=O)C(CCCCCCCC)CCC(CCCCCCCC)C(=O)O)C(=O)O

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GRIK1 P39086 2/20 0.54
GRIK2 Q13002 2/20 0.54
CA2 P00918 2/20 0.52
MAPK1 P28482 1/20 0.52
SLC1A2 P43004 2/20 0.51
SLC1A1 P43005 2/20 0.51
GPR84 Q9NQS5 5/20 0.50
FFAR1 O14842 1/20 0.50
MAPT P10636 1/20 0.48
LCK P06239 1/20 0.48
PPARD Q03181 1/20 0.48
ZDHHC20 Q5W0Z9 1/20 0.48
ZDHHC2 Q9UIJ5 1/20 0.48
CHRM1 P11229 1/20 0.48
AKR1A1 P14550 1/20 0.48
CHRM3 P20309 1/20 0.48
HTR2A P28223 1/20 0.48
HTR2C P28335 1/20 0.48
ADRA1A P35348 1/20 0.48
HRH1 P35367 1/20 0.48

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
SCHEMBL3075648 0.90 CA2 (0.55) GRIK1GRIK2CA2MAPK1SLC1A2
SCHEMBL21409705 0.90 CA2 (0.55) GRIK1GRIK2CA2MAPK1SLC1A2
SCHEMBL27494921 0.88 CA2 (0.59) GRIK1GRIK2CA2MAPK1SLC1A2
SCHEMBL285336 0.88 GRIK1 (0.66) GRIK1GRIK2CA2MAPK1SLC1A2
SCHEMBL1197355 0.88 GRIK1 (0.66) GRIK1GRIK2CA2MAPK1SLC1A2
SCHEMBL542365 0.88 GRIK1 (0.66) GRIK1GRIK2CA2MAPK1SLC1A2
SCHEMBL5594553 0.88 GRIK1 (0.66) GRIK1GRIK2CA2MAPK1SLC1A2
SCHEMBL1117936 0.88 GRIK1 (0.66) GRIK1GRIK2CA2MAPK1SLC1A2
SCHEMBL487044 0.88 GRIK1 (0.66) GRIK1GRIK2CA2MAPK1SLC1A2
SCHEMBL4406612 0.88 GRIK1 (0.66) GRIK1GRIK2CA2MAPK1SLC1A2

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-1178031-B1 PROCESS FOR THE PREPARATION OF ORGANIC COMPOUNDS WITH MANGANESE CATALYSTS OR THE LIKE DAICEL CHEM (JP) 2012-02-01 EP disclosed
US-6548713-B2 Efficiently producing a compound having an alkyl group or alkenyl group bonded at the alpha position of an electron attractive group, by catalytic radical addition reaction with compound of Group 5,6,7,8, or 9 DAICEL CHEMICAL INDUSTRIES, LTD. (JP) 2003-04-15 US disclosed
US-20020165416-A1 Process for the preparation of organic compounds with manganese cataylsts or the like DAICEL CHEMICAL INDUSTRIES, LTD. (JP) 2002-11-07 US disclosed
EP-1178031-A1 PROCESS FOR THE PREPARATION OF ORGANIC COMPOUNDS WITH MANGANESE CATALYSTS OR THE LIKE Daicel Chemical Industries, Ltd. (JP) 2002-02-06 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20020165416-A1 Process for the preparation of organic compounds with manganese cataylsts or the like SOD1, CAT, SOD3 GRIK1 2037/4885GRIK2 2350/4885CA2 512/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.