SCHEMBL513820

SCHEMBL513820

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

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ITPR3 Q14573 8/20 1.00
ITPR2 Q14571 4/20 0.89
ITPR1 Q14643 4/20 0.89
INPP5A Q14642 2/20 0.84
INPPL1 O15357 1/20 0.84
AKT1 P31749 1/20 0.84
SMPD1 P17405 1/20 0.74

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
SCHEMBL8440404 1.00 ITPR3 (1.00) ITPR3ITPR2ITPR1INPP5AINPPL1
SCHEMBL12686382 1.00 ITPR3 (1.00) ITPR3ITPR2ITPR1INPP5AINPPL1
SCHEMBL1342025 1.00 ITPR3 (1.00) ITPR3ITPR2ITPR1INPP5AINPPL1
SCHEMBL9439604 1.00 ITPR3 (1.00) ITPR3ITPR2ITPR1INPP5AINPPL1
SCHEMBL9439428 1.00 ITPR3 (1.00) ITPR3ITPR2ITPR1INPP5AINPPL1
SCHEMBL544343 1.00 ITPR3 (1.00) ITPR3ITPR2ITPR1INPP5AINPPL1
SCHEMBL356762 1.00 ITPR3 (1.00) ITPR3ITPR2ITPR1INPP5AINPPL1
Atrinositol SCHEMBL9022890 0.97 ITPR3 (1.00) ITPR3ITPR2ITPR1INPP5AINPPL1
Atrinositol SCHEMBL180074 0.97 ITPR3 (1.00) ITPR3ITPR2ITPR1INPP5AINPPL1
Atrinositol SCHEMBL888326 0.97 ITPR3 (1.00) ITPR3ITPR2ITPR1INPP5AINPPL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110536940-A SLURRY COMPOSITION FOR CHEMICAL MECHANICAL POLISHING DONGJIN SEMICHEM CO LTD 2019-12-03 CN claimed
CN-106236597-B A kind of oral care composition and its application 好来化工(中山)有限公司 2019-03-19 CN claimed
CN-106236597-A A kind of oral care composition and application thereof 好来化工(中山)有限公司 2016-12-21 CN claimed
CN-105412143-A Oral cavity composition containing polyguanidine compounds and preparation and application method of oral cavity composition COLGATE PALMOLIVE CO 2016-03-23 CN claimed
CN-104125778-A Phytic acid as stabilizer for phytase DANISCO US INC 2014-10-29 CN claimed
CN-103059348-A Capsule skin membrane composition SUNSHO PHARMACEUTICAL CO LTD 2013-04-24 CN claimed
CN-102427795-A Oral compositions containing polyguanidine compounds and methods of making and using the same COLGATE PALMOLIVE CO 2012-04-25 CN claimed
US-20060035810-A1 Regulation of ins(3456)p4 signalling by a reversible kinase phosphatase and methods and compositions related thereto HEALTH AND HUMAN SERVICES NATIONAL INSTITUTES OF HEALTH, UNITED STATES OF AMERICA, THE, AS REPRESENTED BY THE SECRETARY 2006-02-16 US claimed
WO-2003080804-A2 REGULATION OF INS(3456)P4 SIGNALLING BY A REVERSIBLE KINASE/PHOSPHATASE AND METHODS AND COMPOSITIONS RELATED THERETO THE GOVERNMENT OF THE UNITED STATES OF AMERICA, ASREPRESENTED BY THE SECRETARY, DEPARTMENT OF HEALTH AND HUMAN SERVICES, NATIONAL INSTITUTES OF HEALTH (US) 2003-10-02 WO claimed
CN-1359295-A Composition containing carnitine and inositol phosphate as food additive or medicine SIGMA TAU HEALTHSCIENCE SPA (IT) 2002-07-17 CN claimed
EP-0954320-A4 INOSITOL POLYPHOSPHATE DERIVATIVES AND METHODS OF USING SAME UNIV CALIFORNIA (US) 2001-04-04 EP claimed
EP-0954320-A1 INOSITOL POLYPHOSPHATE DERIVATIVES AND METHODS OF USING SAME The Regents of the University of California (US) 1999-11-10 EP claimed
WO-1998011901-A1 INOSITOL POLYPHOSPHATE DERIVATIVES AND METHODS OF USING SAME THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 1998-03-26 WO claimed
JP-8092290-A None JP disclosed
JP-11171749-A None JP disclosed
US-11932893-B2 Microorganisms and methods for producing alkenes GENOMATICA, INC. (US) 2024-03-19 US disclosed
CN-85106903-A ANTICARIOUS ORAL COMPOSITION 1987-03-11 CN disclosed
CN-85109110-A Process for the preparation of inositol triphosphate and compositions thereof 1986-12-03 CN disclosed
EP-0140640-A2 Blood substitute FISONS plc (GB) 1985-05-08 EP disclosed
US-4341558-A ZIRCONIUM OR TITANIUM COMPOUND, SILICA, INOSITOL POLYPHOSPHATE, CORROSION RESISTANCE, PAINT RECEPITIVITY HOOKER CHEMICALS & PLASTICS CORP. (US) 1982-07-27 US disclosed