SCHEMBL3458975

SCHEMBL3458975

O=P(O)(O)C1(P(=O)(O)O)CC2CCCNC2C1

nearest known ligand 0.32

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
FDPS P14324 2/20 0.31
MBTD1 Q05BQ5 1/20 0.30
L3MBTL3 Q96JM7 1/20 0.30

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
SCHEMBL13224024 1.00 FDPS (0.31) FDPSMBTD1L3MBTL3
SCHEMBL3459618 1.00 FDPS (0.31) FDPSMBTD1L3MBTL3
SCHEMBL3458961 1.00 FDPS (0.31) FDPSMBTD1L3MBTL3
Water SCHEMBL8500887 0.98 FDPS (0.30) FDPS
Hydrochloric Acid SCHEMBL3459441 0.98 FDPS (0.30) FDPS
SCHEMBL25674523 0.90
SCHEMBL25674524 0.90
SCHEMBL7860178 0.78 MEN1 (0.33) FDPSMBTD1L3MBTL3
SCHEMBL7797082 0.76 MMP2 (0.37) FDPS
SCHEMBL8712375 0.76

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7781418-B2 enantiomerically pure (1R,6S)-2-Azabicyclo-[4.3.0]nonane-8,8-diphosphonic acid; osteoporosis, osteolytic bone metastasis, rheumatoid arthritis and osteoarthritis; enhanced inhibitory effect on farnesyl pyrophosphate synthase ISIS INNOVATION LTD. (GB) 2010-08-24 US claimed
US-5393746-A Bone disorders P&G PHARMACEUTICALS, INC. (US) 1995-02-28 US claimed
US-5137880-A Treatment for osteoporosis, pagents disease arthritis NORWICH EATON PHARMACEUTICALS, INC. (US) 1992-08-11 US claimed
EP-0273514-B1 NOVEL BICYCLIC DIPHOSPHONATE COMPOUNDS AND PHARMACEUTICAL COMPOSITIONS Norwich Eaton Pharmaceuticals, Inc. (US) 1990-12-12 EP claimed
US-4868164-A OSTEOPOROSIS, ARTHRITIS NORWICH EATON PHARMACEUTICALS, INC. (US) 1989-09-19 US claimed
EP-0273514-A1 Novel bicyclic diphosphonate compounds and pharmaceutical compositions Norwich Eaton Pharmaceuticals, Inc. (US) 1988-07-06 EP claimed
EP-2089403-B1 (1R,6S)-2-AZABICYCLO[4.3.0] NONANE-8,8-DIPHOSPHONIC ACID AND ITS USE IN TREATING OR PREVENTING BONE DISORDERS, FOR EXAMPLE, OSTEOPOROSIS OR PAGET'S DISEASE ISIS INNOVATION (GB) 2014-05-07 EP disclosed
US-7781418-B2 enantiomerically pure (1R,6S)-2-Azabicyclo-[4.3.0]nonane-8,8-diphosphonic acid; osteoporosis, osteolytic bone metastasis, rheumatoid arthritis and osteoarthritis; enhanced inhibitory effect on farnesyl pyrophosphate synthase ISIS INNOVATION LTD. (GB) 2010-08-24 US disclosed
EP-2089403-A1 (1R,6S)-2-AZABICYCLO[4.3.0] NONANE-8,8-DIPHOSPHONIC ACID AND ITS USE IN TREATING OR PREVENTING BONE DISORDERS, FOR EXAMPLE, OSTEOPOROSIS OR PAGET'S DISEASE The Procter & Gamble Company (US) 2009-08-19 EP disclosed
US-20090069272-A1 Composition for treating bone disorders THE PROCTER & GAMBLE COMPANY AND UNIVERSITY OF ROCHESTER (US) 2009-03-12 US disclosed
WO-2008076417-A1 (1R,6S)-2-AZABICYCLO[4.3.0] NONANE-8,8-DIPHOSPHONIC ACID AND ITS USE IN TREATING OR PREVENTING BONE DISORDERS, FOR EXAMPLE, OSTEOPOROSIS OR PAGET'S DISEASE THE PROCTER & GAMBLE COMPANY (US) 2008-06-26 WO disclosed
EP-0643716-B1 QUATERNARY NITROGEN-CONTAINING PHOSPHONATE COMPOUNDS FOR TREATING ABNORMAL CALCIUM AND PHOSPHATE METABOLISM PROCTER & GAMBLE PHARMA (US) 1999-12-08 EP disclosed
US-5869471-A Methods for the treatment of arthritis using phosphonates and NSAIDS THE PROCTOR & GAMBLE COMPANY (US) 1999-02-09 US disclosed
US-5393746-A Bone disorders P&G PHARMACEUTICALS, INC. (US) 1995-02-28 US disclosed
WO-1993024497-A1 THIO-SUBSTITUTED CYCLIC PHOSPHONATE COMPOUNDS FOR TREATING ABNORMAL CALCIUM AND PHOSPHATE METABOLISM PROCTER & GAMBLE PHARMACEUTICALS, INC. (US) 1993-12-09 WO disclosed
WO-1993024499-A1 QUATERNARY NITROGEN-CONTAINING PHOSPHONATE COMPOUNDS FOR TREATING ABNORMAL CALCIUM AND PHOSPHATE METABOLISM PROCTER & GAMBLE PHARMACEUTICALS, INC. (US) 1993-12-09 WO disclosed
US-5137880-A Treatment for osteoporosis, pagents disease arthritis NORWICH EATON PHARMACEUTICALS, INC. (US) 1992-08-11 US disclosed
EP-0273514-B1 NOVEL BICYCLIC DIPHOSPHONATE COMPOUNDS AND PHARMACEUTICAL COMPOSITIONS Norwich Eaton Pharmaceuticals, Inc. (US) 1990-12-12 EP disclosed
US-4868164-A OSTEOPOROSIS, ARTHRITIS NORWICH EATON PHARMACEUTICALS, INC. (US) 1989-09-19 US disclosed
EP-0273514-A1 Novel bicyclic diphosphonate compounds and pharmaceutical compositions Norwich Eaton Pharmaceuticals, Inc. (US) 1988-07-06 EP 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 (1 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-20090069272-A1 Composition for treating bone disorders ACP3, SOST, COL2A1 FDPS 259/4885MBTD1 3750/4885L3MBTL3 4771/4885

“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.