SCHEMBL3080276

SCHEMBL3080276

CC(C)C(=O)O[C@@H]1[C@@H](OC(=O)C(C)C)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@H]1OC(=O)C(C)C

nearest known ligand 0.54

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ITPR3 Q14573 8/20 0.46
ITPR2 Q14571 4/20 0.45
ITPR1 Q14643 4/20 0.45
INPPL1 O15357 1/20 0.45
AKT1 P31749 1/20 0.45
SMPD1 P17405 1/20 0.43
INPP5A Q14642 3/20 0.40
PDPK1 O15530 1/20 0.33
MTOR P42345 1/20 0.33

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
SCHEMBL3073352 1.00 ITPR3 (0.46) ITPR3ITPR2ITPR1INPPL1AKT1
SCHEMBL9000928 0.90 ITPR3 (0.55) ITPR3ITPR2ITPR1INPPL1AKT1
SCHEMBL12858645 0.82 ELANE (0.33)
SCHEMBL1149615 0.82 ELANE (0.33)
SCHEMBL3075449 0.81
SCHEMBL17830379 0.76 ITPR3 (0.52) ITPR3ITPR2ITPR1INPPL1AKT1
SCHEMBL17827502 0.76 ITPR3 (0.52) ITPR3ITPR2ITPR1INPPL1AKT1
Phytic Acid SCHEMBL1681701 0.74 ITPR3 (0.77) ITPR3ITPR2ITPR1INPPL1AKT1
SCHEMBL8467566 0.74 ITPR3 (0.77) ITPR3ITPR2ITPR1INPPL1AKT1
Phytate SCHEMBL136587 0.74 ITPR3 (0.77) ITPR3ITPR2ITPR1INPPL1AKT1

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 23 patents — showing the first 20. 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
EP-0730460-B1 THE USE OF AN ESTER OF INOSITOLTRISPHOSPHATE FOR THE TREATMENT OF INFLAMMATORY CONDITIONS PERSTORP AB (SE) 2002-06-12 EP claimed
US-5866557-A REDUCE TISSUE DAMAGE PERSTORP AB (SE) 1999-02-02 US 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
US-20090175924-A1 COATED STENT BIONERIS AB (SE) 2009-07-09 US disclosed
EP-1390045-B1 THE USE OF A COMPOUND WITH A NEGATIVELY CHARGED DOMAIN OF PHOSPHOROUS-CONTAINING RADICALS FOR THE TREATMENT OF RESTENOSIS BIONERIS AB (SE) 2008-12-03 EP disclosed
US-20050261756-A1 Coated stent BIONERIS AB (SE) 2005-11-24 US disclosed
US-20050227946-A1 METHOD OF TREATING INFLAMMATORY, TISSUE REPAIR AND INFECTIOUS CONDITIONS PERSTORP AB (SE) 2005-10-13 US disclosed
US-6949517-B1 Method of treating inflammatory, tissue repair and infectious conditions SIREN MATTI 2005-09-27 US disclosed
US-6632797-B2 Administering to a mammal a cyclic compound (acyclic, carbocyclic or heterocyclic) substituted by at least three vicinal phosphorus containing radicals for treating angiogenesis in tumor conditions SIREN MATTI (FI) 2003-10-14 US disclosed
EP-0730459-B1 THE USE OF AN ESTER OF INOSITOLTRISPHOSPHATE FOR THE PREPARING OF MEDICAMENTS PERSTORP AB (SE) 2003-02-12 EP disclosed
EP-1216705-A2 The use of growth factor modulation compounds substituted with three vicinal phosphorus containing radical in the manufacture of a medicament for tissue repair PERSTORP AB (SE) 2002-06-26 EP disclosed
EP-0730460-B1 THE USE OF AN ESTER OF INOSITOLTRISPHOSPHATE FOR THE TREATMENT OF INFLAMMATORY CONDITIONS PERSTORP AB (SE) 2002-06-12 EP disclosed
US-20020065253-A1 Use of growth factor modulating compounds SIREN MATTI (FI) 2002-05-30 US disclosed
US-5866557-A REDUCE TISSUE DAMAGE PERSTORP AB (SE) 1999-02-02 US disclosed
EP-0730460-A1 THE USE OF AN ESTER OF INOSITOLTRISPHOSPHATE FOR THE TREATMENT OF INFLAMMATORY CONDITIONS PERSTORP AB (SE) 1996-09-11 EP disclosed
WO-1995014477-A1 THE USE OF AN ESTER OF INOSITOLTRISPHOSPHATE FOR THE TREATMENT OF INFLAMMATORY CONDITIONS PERSTORP AB (SE) 1995-06-01 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 (5 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 ITPR3 3281/4885ITPR2 3937/4885ITPR1 3918/4885
US-20020065253-A1 Use of growth factor modulating compounds HDGF, PGF, FGF2 ITPR3 1805/4885ITPR2 1570/4885ITPR1 1357/4885
US-20160074421-A1 METHOD FOR THE TREATMENT OF DISEASES CAUSED BY HAEMORRHAGIC VIRUSES AND COMPOUNDS FOR USE IN SAID TREATMENT TTPA, LPO, HADHB ITPR3 4534/4885ITPR2 4560/4885ITPR1 4377/4885
US-20090175924-A1 COATED STENT PHOSPHO1, SOST, PLCB3 ITPR3 294/4885ITPR2 432/4885ITPR1 374/4885
US-20050227946-A1 METHOD OF TREATING INFLAMMATORY, TISSUE REPAIR AND INFECTIOUS CONDITIONS TNF, TLR2, TPMT ITPR3 2069/4885ITPR2 1876/4885ITPR1 1529/4885

“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.