SCHEMBL3080640

SCHEMBL3080640

CC(C)COC1C(OCC(C)C)C(OP(=O)(O)OCC(=O)O)C(OP(=O)(O)OCC(=O)O)C(OP(=O)(O)OCC(=O)O)C1OCC(C)C

nearest known ligand 0.35

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 1/20 0.35
MVD P53602 1/20 0.35
PDPK1 O15530 1/20 0.33
MTOR P42345 1/20 0.33
GPR55 Q9Y2T6 1/20 0.32
LAP3 P28838 1/20 0.31
SMPD1 P17405 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
SCHEMBL3085431 1.00 MAPK14 (0.35) MAPK14MVDPDPK1MTORGPR55
SCHEMBL3068650 0.79 PDPK1 (0.37) MVDPDPK1MTORGPR55SMPD1
SCHEMBL3082767 0.79 PDPK1 (0.37) MVDPDPK1MTORGPR55SMPD1
SCHEMBL3081359 0.78 MVD (0.35) MVDGPR55SMPD1
SCHEMBL3077189 0.78 MEN1 (0.33) PDPK1MTOR
SCHEMBL3082895 0.78 MEN1 (0.33) PDPK1MTOR
SCHEMBL3082937 0.77 GBA1 (0.38) MVDPDPK1MTORGPR55SMPD1
SCHEMBL3082560 0.77 GBA1 (0.38) MVDPDPK1MTORGPR55SMPD1
SCHEMBL3073143 0.76 GBA1 (0.44) MAPK14GPR55SMPD1
SCHEMBL3082302 0.76 GBA1 (0.44) MAPK14GPR55SMPD1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100261682-A1 Method and Means for the Treatment of Cachexia BIONERIS AB 2010-10-14 US claimed
EP-2187892-A1 METHOD AND MEANS FOR THE TREATMENT OF CACHEXIA Bioneris AB (SE) 2010-05-26 EP claimed
WO-2009038533-A1 METHOD AND MEANS FOR THE TREATMENT OF CACHEXIA BIONERIS AB (SE) 2009-03-26 WO claimed
US-20160074421-A1 METHOD FOR THE TREATMENT OF DISEASES CAUSED BY HAEMORRHAGIC VIRUSES AND COMPOUNDS FOR USE IN SAID TREATMENT SIRÈN MATTI (FI) 2016-03-17 US disclosed
US-20100261682-A1 Method and Means for the Treatment of Cachexia BIONERIS AB 2010-10-14 US disclosed
EP-2187892-A1 METHOD AND MEANS FOR THE TREATMENT OF CACHEXIA Bioneris AB (SE) 2010-05-26 EP disclosed
WO-2009038533-A1 METHOD AND MEANS FOR THE TREATMENT OF CACHEXIA BIONERIS AB (SE) 2009-03-26 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-20100261682-A1 Method and Means for the Treatment of Cachexia PYGM, GYS1, CPT1B MAPK14 2451/4885MVD 1092/4885PDPK1 3190/4885
US-20160074421-A1 METHOD FOR THE TREATMENT OF DISEASES CAUSED BY HAEMORRHAGIC VIRUSES AND COMPOUNDS FOR USE IN SAID TREATMENT TTPA, LPO, HADHB MAPK14 2546/4885MVD 425/4885PDPK1 3837/4885

“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.