SCHEMBL6520772

SCHEMBL6520772

COCCOC(=O)CC(CC(=O)OCCOC)=C(CC(=O)O)C(=O)O

nearest known ligand 0.33

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.33
ALDH1A1 P00352 1/20 0.33
FNTA P49354 2/20 0.32
FNTB P49356 2/20 0.32
MGAM O43451 1/20 0.30
GAA P10253 1/20 0.30
SI P14410 1/20 0.30
MGAM2 Q2M2H8 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
SCHEMBL6518603 0.92 ALDH1A1 (0.34) TSHRALDH1A1FNTAFNTB
SCHEMBL6520577 0.90 ALDH1A1 (0.39) TSHRALDH1A1FNTAFNTBGAA
SCHEMBL6523736 0.84 TSHR (0.33) TSHRALDH1A1FNTAFNTB
SCHEMBL6516722 0.84 HCAR2 (0.36) ALDH1A1FNTAFNTBMGAMGAA
SCHEMBL6525878 0.83 ALDH1A1 (0.44) TSHRALDH1A1FNTAFNTBMGAM
SCHEMBL6518657 0.83 TDP1 (0.42) TSHRALDH1A1
SCHEMBL6523102 0.83 TSHR (0.38) TSHRALDH1A1MGAMGAASI
SCHEMBL6523095 0.83 TSHR (0.38) TSHRALDH1A1MGAMGAASI
SCHEMBL2634913 0.82 ALDH1A1 (0.41) TSHRALDH1A1MGAMGAASI
SCHEMBL6514927 0.81 DGKA (0.33) TSHRALDH1A1MGAMGAASI

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 TSHR 3581/4885ALDH1A1 1254/4885FNTA 967/4885

“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.