SCHEMBL6520602

SCHEMBL6520602

CCC(=O)CC(CC)=C(CC(=O)O)C(=O)O

nearest known ligand 0.38

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
GRIK1 P39086 1/20 0.38
GRIA4 P48058 1/20 0.38
GRIK3 Q13003 1/20 0.38
GRIK5 Q16478 1/20 0.38
FFAR3 O14843 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
FNTA P49354 1/20 0.35
FNTB P49356 1/20 0.35
LDHA P00338 1/20 0.33
SRR Q9GZT4 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
SCHEMBL6520722 0.93 FFAR3 (0.39) GRIK1GRIA4GRIK3GRIK5FFAR3
SCHEMBL676153 0.86 GRIK1 (0.48) GRIK1GRIA4GRIK3GRIK5FFAR3
SCHEMBL6516114 0.83 GRIK1 (0.38) GRIK1GRIA4GRIK3GRIK5FFAR3
SCHEMBL6521124 0.80 ALDH1A1 (0.35) FNTAFNTB
SCHEMBL4091544 0.79 FFAR3 (0.43) GRIK1GRIA4GRIK3GRIK5FFAR3
SCHEMBL6519762 0.78 TDP1 (0.38) GRIK1GRIA4GRIK3GRIK5FFAR3
SCHEMBL6518738 0.77 AKR1B1 (0.44)
SCHEMBL5796432 0.77 FNTA (0.47) GRIK1GRIA4GRIK3GRIK5FFAR3
SCHEMBL6515518 0.77 HDAC3 (0.42) FFAR3TDP1FNTAFNTB
SCHEMBL6514665 0.76 GAA (0.50) GRIK1GRIA4GRIK3GRIK5FFAR3

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-6958366-B2 Antifouling coating composition and novel resin DAINIPPON INK AND CHEMICALS, INC. (JP) 2005-10-25 US disclosed
US-20030118544-A1 Antifouling coating composition and novel resin DAINIPPON INK AND CHEMICALS, INC. (JP) 2003-06-26 US 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-20030118544-A1 Antifouling coating composition and novel resin COL1A1, GLRA1, COL2A1 GRIK1 271/4885GRIA4 581/4885GRIK3 1201/4885

“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.