SCHEMBL6938703

SCHEMBL6938703

CCCCCCCCOC(=O)C(C)OC

nearest known ligand 0.58

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
NAAA Q02083 1/20 0.53
EPHX1 P07099 1/20 0.50
TSHR P16473 3/20 0.48
HCAR2 Q8TDS4 1/20 0.46
RAD52 P43351 1/20 0.46
NPSR1 Q6W5P4 1/20 0.46
FAAH O00519 1/20 0.44
ALDH1A1 P00352 1/20 0.44
LMNA P02545 1/20 0.44
ACHE P22303 6/20 0.44
DGKA P23743 1/20 0.44

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
SCHEMBL446183 0.92 ALDH1A1 (0.52) NAAAEPHX1TSHRHCAR2NPSR1
SCHEMBL12081975 0.84 DGKA (0.56) NAAAALDH1A1LMNADGKA
SCHEMBL7200378 0.84 NAAA (0.53) NAAAEPHX1TSHRHCAR2RAD52
SCHEMBL195164 0.83 HCAR2 (0.39) NAAATSHRHCAR2ALDH1A1LMNA
SCHEMBL9486309 0.82 NAAA (0.52) NAAAEPHX1TSHRHCAR2RAD52
SCHEMBL9486769 0.82 NAAA (0.52) NAAAEPHX1TSHRHCAR2RAD52
SCHEMBL9486935 0.82 NAAA (0.52) NAAAEPHX1TSHRHCAR2RAD52
SCHEMBL9487881 0.82 NAAA (0.52) NAAAEPHX1TSHRHCAR2RAD52
SCHEMBL9488398 0.82 NAAA (0.52) NAAAEPHX1TSHRHCAR2RAD52
SCHEMBL9487272 0.82 NAAA (0.52) NAAAEPHX1TSHRHCAR2RAD52

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12054685-B1 Coupling high yield biochemical intermediates for fuel production NATIONAL TECHNOLOGY & ENGINEERING SOLUTIONS OF SANDIA, LLC (US) 2024-08-06 US disclosed
CN-1190441-C Phosphine sulfide preparing process and use thereof MITSUI CHEMICALS INC (JP) 2005-02-23 CN disclosed
EP-0972776-B1 A phosphine sulfide, a manufacturing process therefor and a use thereof MITSUI CHEMICALS INC (JP) 2003-04-23 EP disclosed
US-6153794-A Phosphine sulfide, a manufacturing process therefor and use thereof MITSUI CHEMICALS, INC. (JP) 2000-11-28 US disclosed
CN-1262276-A Phosphine sulfide preparing process and use thereof MITSUI CHEMICALS INC (JP) 2000-08-09 CN disclosed
EP-0972776-A1 A phosphine sulfide, a manufacturing process therefor and a use thereof Mitsui Chemicals, Inc. (JP) 2000-01-19 EP 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-12054685-B1 Coupling high yield biochemical intermediates for fuel production ADH1C, ADH5, CBR3 NAAA 622/4885EPHX1 549/4885TSHR 4241/4885

“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.