SCHEMBL6515845

SCHEMBL6515845

C=C(C(=O)O)C(C(=O)O)(C(C)C(=O)OCCOCC)C(C)C(=O)OCCOCC

nearest known ligand 0.44

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
THRB P10828 1/20 0.44
TSHR P16473 2/20 0.41
ALDH1A1 P00352 1/20 0.41
HSD17B10 Q99714 1/20 0.33
GAA P10253 1/20 0.30
TDP1 Q9NUW8 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
SCHEMBL6520315 0.90 THRB (0.33) THRBHSD17B10
SCHEMBL6514768 0.87 TSHR (0.36) THRBTSHRALDH1A1HSD17B10
SCHEMBL6517090 0.86 HCAR2 (0.33)
SCHEMBL6518789 0.85 ALDH1A1 (0.32) TSHRALDH1A1HSD17B10GAA
SCHEMBL6524297 0.84 TSHR (0.31) TSHR
SCHEMBL6520567 0.83 ALDH1A1 (0.39) TSHRALDH1A1TDP1
SCHEMBL6513669 0.81 TSHR (0.45) TSHRALDH1A1
SCHEMBL6523827 0.80 SMN1; SMN2 (0.40) ALDH1A1GAA
SCHEMBL6523867 0.80 TDP1 (0.37) TSHRALDH1A1HSD17B10TDP1
SCHEMBL6516645 0.79 ALDH1A1 (0.33) ALDH1A1

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 THRB 3136/4885TSHR 3581/4885ALDH1A1 1254/4885

“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.