SCHEMBL8606994

SCHEMBL8606994

O=P(O)(O)C1(P(=O)(O)O)CCC2CCNCC21

nearest known ligand 0.00

⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.

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
SCHEMBL8605354 0.86
SCHEMBL8465658 0.74 GAA (0.31)
SCHEMBL9740737 0.73 TSHR (0.31)
SCHEMBL8715216 0.67 SLC6A1 (0.32)
SCHEMBL8501288 0.67 ANPEP (0.30)
SCHEMBL8467915 0.66
SCHEMBL8468319 0.66
SCHEMBL8610112 0.64 MAPT (0.32)
SCHEMBL8468237 0.63
SCHEMBL8714867 0.62 SLC6A1 (0.33)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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
EP-0273514-A1 Novel bicyclic diphosphonate compounds and pharmaceutical compositions Norwich Eaton Pharmaceuticals, Inc. (US) 1988-07-06 EP claimed
US-5869471-A Methods for the treatment of arthritis using phosphonates and NSAIDS THE PROCTOR & GAMBLE COMPANY (US) 1999-02-09 US disclosed
US-5763611-A TREATING OSTEOPOROSIS, RHEUMATOID ARTHRITIS THE PROCTER & GAMBLE COMPANY (US) 1998-06-09 US disclosed
EP-0650361-A1 COMPOSITIONS FOR THE TREATMENT OF ARTHRITIS CONTAINING PHOSPHONATES AND NSAIDS PROCTER &amp; GAMBLE PHARMACEUTICALS, INC. (US) 1995-05-03 EP disclosed
EP-0642520-A1 THIO-SUBSTITUTED CYCLIC PHOSPHONATE COMPOUNDS FOR TREATING ABNORMAL CALCIUM AND PHOSPHATE METABOLISM PROCTER & GAMBLE PHARMACEUTICALS (US) 1995-03-15 EP disclosed
US-5393746-A Bone disorders P&G PHARMACEUTICALS, INC. (US) 1995-02-28 US disclosed
WO-1994000130-A1 COMPOSITIONS FOR THE TREATMENT OF ARTHRITIS CONTAINING PHOSPHONATES AND NSAIDS PROCTER & GAMBLE PHARMACEUTICALS, INC. (US) 1994-01-06 WO 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
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