SCHEMBL15955988

SCHEMBL15955988

CC(=O)OCC1COC(C)(CC(C)C)O1

nearest known ligand 0.37

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CTDSP1 Q9GZU7 1/20 0.37
ALDH1A1 P00352 1/20 0.35
CA2 P00918 1/20 0.35
PDK1 Q15118 1/20 0.33
NLRP3 Q96P20 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
SCHEMBL15955749 0.90 CTDSP1 (0.36) CTDSP1ALDH1A1CA2
SCHEMBL15955777 0.87 CTDSP1 (0.38) CTDSP1ALDH1A1CA2
SCHEMBL15956025 0.87 CTDSP1 (0.40) CTDSP1ALDH1A1CA2
SCHEMBL923989 0.86 ALDH1A1 (0.55) CTDSP1ALDH1A1CA2
SCHEMBL21525856 0.86 CTDSP1 (0.34) CTDSP1ALDH1A1CA2
SCHEMBL774725 0.85 TSHR (0.41) CTDSP1ALDH1A1CA2
SCHEMBL15955971 0.85 CTDSP1 (0.39) CTDSP1NLRP3
SCHEMBL15956052 0.83 LPAR1 (0.39) CTDSP1
SCHEMBL17854784 0.83 CTDSP1 (0.35) CTDSP1ALDH1A1CA2
SCHEMBL13949197 0.83 CTDSP1 (0.35) CTDSP1ALDH1A1CA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112063219-B Solvent system and composition thereof 罗狄亚聚酰胺特殊品有限公司 2022-12-20 CN disclosed
CN-112063219-A Solvent system and composition thereof 罗狄亚聚酰胺特殊品有限公司 2020-12-11 CN disclosed
CN-104995265-B Solvent system and composition thereof 罗狄亚聚酰胺特殊品有限公司 2020-12-08 CN disclosed
US-10239116-B2 Solvent system and compositions therewith RHODIA POLIAMIDA E ESPECIALIDADES LTDA (BR) 2019-03-26 US disclosed
EP-2956513-B1 SOLVENT SYSTEM AND COMPOSITIONS THEREWITH RHODIA POLIAMIDA E ESPECIALIDADES LTDA (BR) 2017-09-27 EP disclosed
EP-2956513-A1 SOLVENT SYSTEM AND COMPOSITIONS THEREWITH Rhodia Poliamida E Especialidades Ltda (BR) 2015-12-23 EP disclosed
US-20150361281-A1 SOLVENT SYSTEM AND COMPOSITIONS THEREWITH RHODIA POLIAMIDA E ESPECIALIDADES LTDA (BR) 2015-12-17 US disclosed
WO-2014125357-A1 SOLVENT SYSTEM AND COMPOSITIONS THEREWITH RHODIA POLIAMIDA E ESPECIALIDADES LTDA (BR) 2014-08-21 WO 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 (2 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-20150361281-A1 SOLVENT SYSTEM AND COMPOSITIONS THEREWITH DECR1, SQLE, DECR2 CTDSP1 696/4885ALDH1A1 297/4885CA2 2745/4885
US-10239116-B2 Solvent system and compositions therewith DECR1, SQLE, DECR2 CTDSP1 696/4885ALDH1A1 297/4885CA2 2745/4885

“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.