SCHEMBL18679873

SCHEMBL18679873

COCC(=O)OC(C)C(=O)OCCO

nearest known ligand 0.32

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.32
TSHR P16473 1/20 0.31
ACHE P22303 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
SCHEMBL9888822 0.81 MGAM (0.38) ALDH1A1TSHR
SCHEMBL26493792 0.80 TDP1 (0.30) TSHR
SCHEMBL26948072 0.79 TSHR (0.36) TSHR
SCHEMBL2842381 0.78
SCHEMBL18252660 0.77 ALDH1A1 (0.33) ALDH1A1TSHR
SCHEMBL11985994 0.76 EGLN1 (0.37) ALDH1A1TSHR
SCHEMBL11985991 0.76 ADRA2A (0.34) ALDH1A1TSHR
SCHEMBL12859220 0.76 TSHR (0.33) ALDH1A1TSHR
SCHEMBL15084386 0.76
SCHEMBL15024612 0.76 TSHR (0.35) TSHR

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-20170087167-A1 MODIFICATION OF DRUGS FOR INCORPORATION INTO NANOPARTICLES THE GOVERNMENT OF THE UNITED STATES, AS REPRESENTED BY THE SECRETARY OF THE ARMY 2017-03-30 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-20170087167-A1 MODIFICATION OF DRUGS FOR INCORPORATION INTO NANOPARTICLES NLN, PRNP, TPMT ALDH1A1 174/4885TSHR 4627/4885ACHE 143/4885

“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.