SCHEMBL6516728

SCHEMBL6516728

C=C(C(=O)O)C(CC(=O)OCCC)(CC(=O)OCCC)C(=O)O

nearest known ligand 0.38

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.37
LMNA P02545 3/20 0.37
HCAR2 Q8TDS4 1/20 0.34
NAAA Q02083 1/20 0.32
TET2 Q6N021 1/20 0.32
DGKA P23743 1/20 0.32
PPM1B O75688 1/20 0.31
PTPN1 P18031 1/20 0.31
PPP1CC P36873 1/20 0.31
TP53 P04637 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
SCHEMBL6519644 0.92 LMNA (0.35) ALDH1A1LMNAHCAR2
SCHEMBL6514935 0.91 ALDH1A1 (0.34) ALDH1A1LMNADGKATP53
SCHEMBL6515982 0.90 NAAA (0.41) ALDH1A1LMNAHCAR2NAAADGKA
SCHEMBL6514774 0.87 NAAA (0.50) ALDH1A1LMNAHCAR2NAAADGKA
SCHEMBL6513350 0.87 THRB (0.34) ALDH1A1LMNA
SCHEMBL6514741 0.86 GAA (0.40) ALDH1A1LMNATET2PTPN1
SCHEMBL6525875 0.85 THRB (0.45) ALDH1A1
SCHEMBL6520770 0.85 TSHR (0.32) TET2
SCHEMBL6515080 0.85 TSHR (0.37) ALDH1A1LMNAHCAR2NAAADGKA
SCHEMBL6519500 0.84 ALDH1A1 (0.32) ALDH1A1LMNA

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 ALDH1A1 1254/4885LMNA 2459/4885HCAR2 3143/4885

“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.