SCHEMBL18679884

SCHEMBL18679884

CCCCCCCCOC(=O)C(C)(COC(=O)C(C)(CO)CO)COC(=O)C(C)(CO)CO

nearest known ligand 0.46

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
NAAA Q02083 1/20 0.46
RAD52 P43351 1/20 0.44
NPSR1 Q6W5P4 1/20 0.44
EPHX1 P07099 1/20 0.43
TSHR P16473 3/20 0.42
HCAR2 Q8TDS4 1/20 0.40
FAAH O00519 1/20 0.39
ALDH1A1 P00352 1/20 0.39
LMNA P02545 1/20 0.39
ACHE P22303 9/20 0.39

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
SCHEMBL3908462 0.93 NAAA (0.52) NAAARAD52NPSR1EPHX1TSHR
SCHEMBL18679878 0.93 NAAA (0.52) NAAARAD52NPSR1EPHX1TSHR
SCHEMBL28284649 0.93 NAAA (0.52) NAAARAD52NPSR1EPHX1TSHR
SCHEMBL1499895 0.93 NAAA (0.52) NAAARAD52NPSR1EPHX1TSHR
SCHEMBL1537692 0.93 NAAA (0.52) NAAARAD52NPSR1EPHX1TSHR
SCHEMBL19367023 0.93 NAAA (0.52) NAAARAD52NPSR1EPHX1TSHR
SCHEMBL19367026 0.88 NAAA (0.41) NAAARAD52NPSR1EPHX1TSHR
SCHEMBL13635968 0.86 HCAR2 (0.33) TSHRHCAR2ALDH1A1LMNA
SCHEMBL15334588 0.86 HCAR2 (0.33) TSHRHCAR2ALDH1A1LMNA
SCHEMBL8384168 0.86 ALDH1A1 (0.50) NAAAEPHX1TSHRHCAR2ALDH1A1

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-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
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 NAAA 110/4885RAD52 4855/4885NPSR1 512/4885

“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.