SCHEMBL219762

SCHEMBL219762

O=P(O)(O)OP(=O)(O)OC1C(O)C(O)C(O)C(OP(=O)(O)OP(=O)(O)O)C1OP(=O)(O)OP(=O)(O)O

nearest known ligand 0.77

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ITPR3 Q14573 8/20 0.67
ITPR1 Q14643 4/20 0.62
ITPR2 Q14571 3/20 0.62
INPP5A Q14642 2/20 0.54
INPPL1 O15357 1/20 0.54
AKT1 P31749 1/20 0.54
SMPD1 P17405 1/20 0.46

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
SCHEMBL237183 1.00 ITPR3 (0.67) ITPR3ITPR1ITPR2INPP5AINPPL1
SCHEMBL220555 1.00 ITPR3 (0.67) ITPR3ITPR1ITPR2INPP5AINPPL1
SCHEMBL19712146 0.98 ITPR3 (0.65) ITPR3ITPR1ITPR2INPP5AINPPL1
SCHEMBL5176539 0.98 ITPR3 (0.65) ITPR3ITPR1ITPR2INPP5AINPPL1
SCHEMBL14992390 0.96 ITPR3 (0.61) ITPR3ITPR1ITPR2INPP5AINPPL1
SCHEMBL11233751 0.93 ITPR3 (0.60) ITPR3ITPR1ITPR2INPP5AINPPL1
SCHEMBL7171543 0.93 ITPR3 (0.60) ITPR3ITPR1ITPR2INPP5AINPPL1
SCHEMBL4343592 0.93 ITPR3 (0.74) ITPR3ITPR1ITPR2INPP5AINPPL1
SCHEMBL4343591 0.93 ITPR3 (0.74) ITPR3ITPR1ITPR2INPP5AINPPL1
SCHEMBL6664274 0.93 ITPR3 (0.74) ITPR3ITPR1ITPR2INPP5AINPPL1

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 152 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115260767-B Flame-retardant high-temperature vulcanized silicone rubber and preparation method thereof 深圳市捷超行模具有限公司 2023-09-15 CN claimed
CN-112074276-A Inositol-based immunotherapy 诺姆奥克塞斯公司 2020-12-11 CN claimed
EP-2451459-B1 METHOD OF REDUCING MULTI-DRUG RESISTANCE USING INOSITOL TRIPYROPHOSPHATE NORMOXYS INC (US) 2017-11-22 EP claimed
US-20160235771-A1 METHOD OF REDUCING MULTI-DRUG RESISTANCE USING INOSITOL TRIPYROPHOSPHATE NORMOXYS, INC. 2016-08-18 US claimed
US-20160120887-A9 TUMOR ERADICATION BY INOSITOL-TRIPYROPHOSPHATE NORMOXYS, INC. (US) 2016-05-05 US claimed
US-20160067267-A1 MYO-INOSITOL TRISPYROPHOSPHATE AS AN ANTI-OBESITY AGENT NORMOXYS, INC. (US) 2016-03-10 US claimed
EP-2968617-A1 MYO-INOSITOL TRISPYROPHOSPHATE AS AN ANTI-OBESITY AGENT NormOxys, Inc. (US) 2016-01-20 EP claimed
EP-1973398-B1 USE OF INOSITOL-TRIPYROPHOSPHATE IN TREATING TUMORS MEDIATED BY ANGIOGENESIS NORMOXYS INC (US) 2016-01-06 EP claimed
WO-2014143939-A1 MYO-INOSITOL TRISPYROPHOSPHATE AS AN ANTI-OBESITY AGENT NORMOXYS, INC. (US) 2014-09-18 WO claimed
US-20140194391-A1 CALCIUM/SODIUM SALT OF INOSITOL TRIPYROPHOSPHATE AS AN ALLOSTERIC EFFECTOR OF HEMOGLOBIN UNIVERSITE DE STRASBOURG (FR) 2014-07-10 US claimed
WO-2007081315-A1 USE OF INOSITOL-TRIPYROPHOSPHATE IN TREATING TUMORS AND DISEASES OXYPLUS, INC. (US) 2007-07-19 WO claimed
US-20070135389-A1 calcium and sodium mixed salt of inositol tripyrophosphate; anticancer NORMOXYS, INC. 2007-06-14 US claimed
US-20060258626-A1 Cancer, stroke, Alzheimer's, osteoporosis; angiogenesis inhibitor, antihypoxic agent NORMOXYS, INC. 2006-11-16 US claimed
US-20060241086-A1 Calcium salt of myo-inositol 1,6:2,3:4,5 tripyrophosphate as an allosteric effector of hemoglobin NORMOXYS, INC. 2006-10-26 US claimed
WO-2006102060-A1 CALCIUM SALT OF MYO-INOSITOL 1,6:2,3:4,5 TRIPYROPHOSPHATE AS AN ALLOSTERIC EFFECTOR OF HEMOGLOBIN OXYPLUS, INC. (US) 2006-09-28 WO claimed
US-20060116358-A1 Delivering modified inositol hexaphosphate (IHP); enhance the ability of mammalian red blood cells to deliver oxygen, by delivering IHP to the cytoplasm of the red blood cells; cardiovascular and respiratory disorders NORMOXYS, INC. 2006-06-01 US claimed
US-20060106000-A1 Use of inositol-tripyrophosphate in treating tumors and diseases NORMOXYS, INC. 2006-05-18 US claimed
EP-1503768-A1 INOSITOL PYROPHOSPHATES, AND METHODS OF USE THEREOF GMP Oxycell, Inc. (US) 2005-02-09 EP claimed
US-20040014642-A1 Supplying oxygen to cells; antiischemic agents; cardiovascular disorders NORMOXYS, INC. 2004-01-22 US claimed
WO-2003092700-A1 INOSITOL PYROPHOSPHATES, AND METHODS OF USE THEREOF GMP OXYCELL, INC. (US) 2003-11-13 WO claimed

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-20060106000-A1 Use of inositol-tripyrophosphate in treating tumors and diseases PPIP5K2, ITPA, INPP5B ITPR3 10/4885ITPR1 9/4885ITPR2 13/4885
US-20060241086-A1 Calcium salt of myo-inositol 1,6:2,3:4,5 tripyrophosphate as an allosteric effector of hemoglobin ITPR3, ITPR1, ITPR2 ITPR3 1/4885ITPR1 2/4885ITPR2 3/4885
US-20040014642-A1 Supplying oxygen to cells; antiischemic agents; cardiovascular disorders PPIP5K2, ITPA, DHPS ITPR3 30/4885ITPR1 22/4885ITPR2 24/4885
US-20060116358-A1 Delivering modified inositol hexaphosphate (IHP); enhance the ability of mammalian red blood cells to deliver oxygen, by delivering IHP to the cytoplasm of the red blood cells; cardiovascular and respiratory disorders PPIP5K2, ITPA, INPP5B ITPR3 10/4885ITPR1 9/4885ITPR2 15/4885
US-20060258626-A1 Cancer, stroke, Alzheimer's, osteoporosis; angiogenesis inhibitor, antihypoxic agent HIF1AN, GPR119, IGF1R ITPR3 35/4885ITPR1 25/4885ITPR2 36/4885
US-20160120887-A9 TUMOR ERADICATION BY INOSITOL-TRIPYROPHOSPHATE PPIP5K2, ITPR3, ITPR1 ITPR3 2/4885ITPR1 3/4885ITPR2 4/4885

“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.