SCHEMBL3073446

SCHEMBL3073446

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

nearest known ligand 0.54

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ITPR3 Q14573 7/20 0.46
ITPR2 Q14571 3/20 0.45
ITPR1 Q14643 3/20 0.45
INPPL1 O15357 1/20 0.45
AKT1 P31749 1/20 0.45
SMPD1 P17405 1/20 0.43
PPIP5K2 O43314 1/20 0.42
INPP5A Q14642 1/20 0.40
TLR4 O00206 1/20 0.38
LY96 Q9Y6Y9 1/20 0.38
PDPK1 O15530 1/20 0.37
MTOR P42345 1/20 0.37

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
SCHEMBL3086364 1.00 ITPR3 (0.46) ITPR3ITPR2ITPR1INPPL1AKT1
SCHEMBL9000922 0.90 ITPR3 (0.55) ITPR3ITPR2ITPR1INPPL1AKT1
SCHEMBL15134078 0.84 ITPR3 (0.43) ITPR3ITPR2ITPR1INPPL1AKT1
SCHEMBL8498941 0.84 ITPR3 (0.43) ITPR3ITPR2ITPR1INPPL1AKT1
SCHEMBL3078845 0.84 ITPR3 (0.43) ITPR3ITPR2ITPR1INPPL1AKT1
SCHEMBL6388024 0.84 ITPR3 (0.43) ITPR3ITPR2ITPR1INPPL1AKT1
SCHEMBL5667749 0.84 ITPR3 (0.43) ITPR3ITPR2ITPR1INPPL1AKT1
SCHEMBL8845346 0.84 ITPR3 (0.43) ITPR3ITPR2ITPR1INPPL1AKT1
SCHEMBL8844497 0.84 ITPR3 (0.43) ITPR3ITPR2ITPR1INPPL1AKT1
SCHEMBL6389556 0.84 ITPR3 (0.43) 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 20 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-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
EP-1545643-A1 COATED STENT Bioneris AB, (SE) 2005-06-29 EP disclosed
US-20040235799-A1 Use of a compound with a negatively charged domain of radicals for the treatment of restenosis BIONERIS AB (SE) 2004-11-25 US disclosed
WO-2004022123-A1 COATED STENT BIONERIS AB (SE) 2004-03-18 WO 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
US-5846957-A Use of an ester of inositoltrisphosphate for the preparing of medicaments PERSTORP AB (SE) 1998-12-08 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 (6 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-20040235799-A1 Use of a compound with a negatively charged domain of radicals for the treatment of restenosis PCNA, OPRK1, OGFR ITPR3 3145/4885ITPR2 3537/4885ITPR1 3269/4885
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.