SCHEMBL6518548

SCHEMBL6518548

CCOCCOC(=O)C(C)/C(C(=O)O)=C(\C(=O)O)C(C)C(=O)OCCOCC

nearest known ligand 0.50

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.50
TSHR P16473 2/20 0.50
THRB P10828 1/20 0.44
HSD17B10 Q99714 2/20 0.41
SMN1; SMN2 Q16637 2/20 0.34
GAA P10253 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.33
KDM4E B2RXH2 1/20 0.31

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
SCHEMBL6518556 1.00 ALDH1A1 (0.50) ALDH1A1TSHRTHRBHSD17B10SMN1; SMN2
SCHEMBL6513684 0.87 HSD17B10 (0.36) ALDH1A1TSHRTHRBHSD17B10TDP1
SCHEMBL6513694 0.87 HSD17B10 (0.36) ALDH1A1TSHRTHRBHSD17B10TDP1
SCHEMBL10233231 0.86 ALDH1A1 (0.60) ALDH1A1TSHRTHRBHSD17B10SMN1; SMN2
SCHEMBL6524369 0.84 TSHR (0.39) ALDH1A1TSHRTHRBHSD17B10
SCHEMBL6524363 0.84 TSHR (0.39) ALDH1A1TSHRTHRBHSD17B10
SCHEMBL6521022 0.82 HCAR2 (0.41) ALDH1A1TSHRHSD17B10SMN1; SMN2GAA
SCHEMBL6521016 0.82 HCAR2 (0.41) ALDH1A1TSHRHSD17B10SMN1; SMN2GAA
SCHEMBL15709922 0.81 ALDH1A1 (0.42) ALDH1A1HSD17B10GAA
SCHEMBL15710095 0.81 ALDH1A1 (0.42) ALDH1A1HSD17B10GAA

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 1254/4885TSHR 3581/4885THRB 3136/4885

“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.