SCHEMBL1668785

SCHEMBL1668785

NCCCC(O)(O[PH](=O)O)O[PH](=O)O

nearest known ligand 0.39

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
FDPS P14324 4/20 0.39
PDE3A Q14432 1/20 0.39
ODC1 P11926 2/20 0.31

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
SCHEMBL10073144 0.92 FDPS (0.42) FDPSPDE3A
SCHEMBL10073146 0.86 LMNA (0.34) FDPSPDE3A
SCHEMBL8259996 0.85 FDPS (0.32) FDPSPDE3A
SCHEMBL13334523 0.77 FDPS (0.33) FDPSPDE3AODC1
SCHEMBL12848975 0.77
SCHEMBL10322589 0.75 FDPS (0.50) FDPSPDE3A
SCHEMBL15492659 0.74
SCHEMBL14217571 0.72
Phosphonic Acid SCHEMBL17105021 0.72 FDPS (0.44) FDPSPDE3AODC1
SCHEMBL15492660 0.71 EPHX1 (0.34)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170164642-A1 Preservative System For Acidic Beverages Based On Sequestrants PEPSICO, INC. 2017-06-15 US disclosed
US-9611284-B2 Prostaglandin-bisphosphonate conjugate compounds, methods of making same, and uses thereof SIMON FRASER UNIVERSITY (CA) 2017-04-04 US disclosed
US-9560871-B2 Preservative system for acidic beverages based on sequestrants PEPSICO, INC. (US) 2017-02-07 US disclosed
US-9119884-B2 LLP2A-bisphosphonate conjugates for osteoporosis treatment THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2015-09-01 US disclosed
US-20140056855-A1 LLP2A-BISPHOSPHONATE CONJUGATES FOR OSTEOPOROSIS TREATMENT THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2014-02-27 US disclosed
US-20120202756-A1 USE OF PRODRUGS TO AVOID GI MEDIATED ADVERSE EVENTS FRANKLIN RICHARD (GB) 2012-08-09 US disclosed
WO-2012054807-A2 VACCINES COMPRISING BISPHOSPHONATE AND METHODS OF USE THEREOF PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 2012-04-26 WO disclosed
WO-2012046062-A1 USE OF PRODRUGS TO AVOID GI MEDIATED ADVERSE EVENTS SHIRE, LLC (US) 2012-04-12 WO disclosed
WO-2010078069-A1 PRESERVATIVE SYSTEM FOR ACIDIC BEVERAGES BASED ON SEQUESTRANTS PEPSICO, INC. (US) 2010-07-08 WO disclosed
US-20100166917-A1 Preservative System For Acidic Beverages Based On Sequestrants PEPSICO, INC. (US) 2010-07-01 US disclosed
US-7662977-B2 PI-3 kinase inhibitor prodrugs SEMAFORE PHARMACEUTICALS, INC. (US) 2010-02-16 US disclosed
US-20080292714-A1 BONE TARGETING OF DEGRADABLE DRUG FILLED NANOPARTICLES SEMAFORE PHARMACEUTICALS INC. (US) 2008-11-27 US disclosed
US-20080188423-A1 PI-3 KINASE INHIBITOR PRODRUGS SIGNALRX PHARMACEUTICALS, INC. 2008-08-07 US disclosed
US-7396828-B2 PI-3 kinase inhibitor prodrugs SEMAFORE PHARMACEUTICALS, INC. (US) 2008-07-08 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 (4 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-20120202756-A1 USE OF PRODRUGS TO AVOID GI MEDIATED ADVERSE EVENTS OPRM1, UGT1A6, UGT1A4 FDPS 1999/4885PDE3A 825/4885ODC1 2267/4885
US-20140056855-A1 LLP2A-BISPHOSPHONATE CONJUGATES FOR OSTEOPOROSIS TREATMENT LCP1, BST2, ITGA2B FDPS 1878/4885PDE3A 4282/4885ODC1 4127/4885
US-20080188423-A1 PI-3 KINASE INHIBITOR PRODRUGS PI4KA, PI4KB, PI4K2B FDPS 1903/4885PDE3A 552/4885ODC1 1835/4885
US-20080292714-A1 BONE TARGETING OF DEGRADABLE DRUG FILLED NANOPARTICLES BMP2, BMP6, SOST FDPS 1012/4885PDE3A 2464/4885ODC1 3952/4885

“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.