SCHEMBL12200413

SCHEMBL12200413

CC(C)=C(CCO)C(=O)O

nearest known ligand 0.43

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
GRIK1 P39086 1/20 0.43
FNTA P49354 3/20 0.37
FNTB P49356 3/20 0.37
THRB P10828 1/20 0.37
PGGT1B P53609 1/20 0.37
LMNA P02545 1/20 0.33
SLC15A2 Q16348 1/20 0.33
ALDH1A1 P00352 1/20 0.33
CAMK2A Q9UQM7 1/20 0.33
FFAR3 O14843 1/20 0.32
LCK P06239 1/20 0.32
FYN P06241 1/20 0.32
GPR84 Q9NQS5 1/20 0.31
FFAR1 O14842 1/20 0.31
FFAR4 Q5NUL3 1/20 0.31
OR51E2 Q9H255 1/20 0.30
CA1 P00915 1/20 0.30

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
SCHEMBL19813750 0.83 FNTA (0.37) GRIK1FNTAFNTBTHRBPGGT1B
SCHEMBL19813751 0.83 FNTA (0.37) GRIK1FNTAFNTBTHRBPGGT1B
SCHEMBL811611 0.82 FNTA (0.48) FNTAFNTBTHRBPGGT1BLMNA
SCHEMBL215122 0.82 FNTA (0.48) FNTAFNTBTHRBPGGT1BLMNA
SCHEMBL215123 0.82 FNTA (0.48) FNTAFNTBTHRBPGGT1BLMNA
Methacrylic Acid SCHEMBL11434669 0.79 FNTA (0.39) GRIK1FNTAFNTBTHRBPGGT1B
SCHEMBL7266900 0.79 GRIK1 (0.35) GRIK1FNTAFNTBTHRBPGGT1B
Methacrylic Acid SCHEMBL11434666 0.79 FNTA (0.39) GRIK1FNTAFNTBTHRBPGGT1B
SCHEMBL7266902 0.79 GRIK1 (0.35) GRIK1FNTAFNTBTHRBPGGT1B
SCHEMBL6681026 0.79 GRIK1 (0.35) GRIK1FNTAFNTBTHRBPGGT1B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110244531-A1 SYNTHESIS ROUTES TO 2(S),4(S),5(S),7(S)-2,7-DIALKYL-4-HYDROXY-5-AMINO-8-ARYL-OCTANOYL AMIDES JLL/DELTA DUTCH NEWCO B.V. (NL) 2011-10-06 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-20110244531-A1 SYNTHESIS ROUTES TO 2(S),4(S),5(S),7(S)-2,7-DIALKYL-4-HYDROXY-5-AMINO-8-ARYL-OCTANOYL AMIDES KHK, AGTR2, HK2 GRIK1 573/4885FNTA 3952/4885FNTB 3699/4885

“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.