SCHEMBL7799786

SCHEMBL7799786

CP(=O)(O)P(=O)(O)O.NCCCCO

nearest known ligand 0.50

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
GABBR2 O75899 4/20 0.50
GABBR1 Q9UBS5 4/20 0.50
CYP1A2 P05177 1/20 0.50
TSHR P16473 1/20 0.50
THPO P40225 1/20 0.50
BLM P54132 3/20 0.48
LMNA P02545 2/20 0.48
CYP3A4 P08684 1/20 0.42
NFKB1 P19838 1/20 0.42
PMP22 Q01453 1/20 0.42
FDPS P14324 3/20 0.40
GABRR1 P24046 1/20 0.40
PDE3A Q14432 1/20 0.37
DRD3 P35462 1/20 0.35
ALDH1A1 P00352 1/20 0.35
PAOX Q6QHF9 1/20 0.34

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
SCHEMBL8949817 0.98 GABBR2 (0.48) GABBR2GABBR1CYP1A2TSHRTHPO
SCHEMBL8949921 0.98 GABBR2 (0.48) GABBR2GABBR1CYP1A2TSHRTHPO
SCHEMBL8949690 0.93 GABBR2 (0.52) GABBR2GABBR1CYP1A2TSHRTHPO
Phosphoric Acid SCHEMBL27508186 0.85 LMNA (0.50) GABBR2GABBR1CYP1A2TSHRTHPO
Phosphoric Acid SCHEMBL28144890 0.82 FDPS (0.48) GABBR2GABBR1CYP1A2TSHRTHPO
Phosphoric Acid SCHEMBL3918672 0.82 FDPS (0.48) GABBR2GABBR1CYP1A2TSHRTHPO
SCHEMBL8950061 0.81 GABBR2 (0.56) GABBR2GABBR1CYP1A2TSHRTHPO
SCHEMBL8949882 0.79 DNM1 (0.59) GABBR2GABBR1TSHRFDPSGABRR1
Butylamine SCHEMBL8949981 0.78 GABBR2 (0.58) GABBR2GABBR1CYP1A2TSHRTHPO
Phosphoric Acid SCHEMBL6535607 0.76 BLM (0.52) GABBR2GABBR1CYP1A2TSHRTHPO

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5616560-A Methods for the treatment of osteoporosis using bisphosphonates and parathyroid hormone THE PROCTER & GAMBLE COMPANY (US) 1997-04-01 US claimed
EP-0573604-B1 METHODS FOR THE TREATMENT OF OSTEOPOROSIS PROCTER & GAMBLE PHARMA (US) 1995-03-15 EP claimed
EP-0573604-A1 METHODS FOR THE TREATMENT OF OSTEOPOROSIS. NORWICH EATON PHARMA (US) 1993-12-15 EP claimed
WO-1992014474-A1 METHODS FOR THE TREATMENT OF OSTEOPOROSIS NORWICH EATON PHARMACEUTICALS, INC. (US) 1992-09-03 WO claimed
US-6329354-B1 ADMINISTERING BONE ACTIVE PHOSPHONATE, ADMINISTERING ESTROGEN HORMONE THE PROCTER & GAMBLE COMPANY 2001-12-11 US disclosed
EP-1158987-A1 METHODS OF INCREASING BONE VOLUME USING NON-NATURALLY-OCCURRING FP SELECTIVE AGONISTS AND ANTIRESORPTIVE COMPOUNDS THE PROCTER & GAMBLE COMPANY (US) 2001-12-05 EP disclosed
WO-2000051617-A1 METHODS OF INCREASING BONE VOLUME USING NON-NATURALLY-OCCURRING FP SELECTIVE AGONISTS AND ANTIRESORPTIVE COMPOUNDS THE PROCTER & GAMBLE COMPANY (US) 2000-09-08 WO disclosed
US-5869471-A Methods for the treatment of arthritis using phosphonates and NSAIDS THE PROCTOR & GAMBLE COMPANY (US) 1999-02-09 US disclosed
EP-0648120-B1 USE OF PHOSPHONATES FOR THE TREATMENT OF OSTEOPOROSIS PROCTER & GAMBLE PHARMA (US) 1997-12-29 EP disclosed
US-5574024-A Methylene phosphonoalkylphosphinates, pharmaceutical compositions, and methods for treating abnormal calcium and phosphate metabolism EBETINO FRANK H (US) 1996-11-12 US disclosed
EP-0650361-A1 COMPOSITIONS FOR THE TREATMENT OF ARTHRITIS CONTAINING PHOSPHONATES AND NSAIDS PROCTER & GAMBLE PHARMACEUTICALS, INC. (US) 1995-05-03 EP disclosed
EP-0648120-A1 USE OF PHOSPHONATES FOR THE TREATMENT OF OSTEOPOROSIS PROCTER & GAMBLE PHARMACEUTICALS, INC. (US) 1995-04-19 EP disclosed
EP-0573604-B1 METHODS FOR THE TREATMENT OF OSTEOPOROSIS PROCTER & GAMBLE PHARMA (US) 1995-03-15 EP disclosed
WO-1994000129-A1 USE OF PHOSPHONATES FOR THE TREATMENT OF OSTEOPOROSIS PROCTER & GAMBLE PHARMACEUTICALS, INC. (US) 1994-01-06 WO disclosed
WO-1994000130-A1 COMPOSITIONS FOR THE TREATMENT OF ARTHRITIS CONTAINING PHOSPHONATES AND NSAIDS PROCTER & GAMBLE PHARMACEUTICALS, INC. (US) 1994-01-06 WO disclosed
EP-0298553-B1 METHYLENE PHOSPHONOALKYLPHOSPHINATES, PHARMACEUTICAL COMPOSITIONS, AND METHODS FOR TREATING ABNORMAL CALCIUM AND PHOSPHATE METABOLISM Norwich Eaton Pharmaceuticals, Inc. (US) 1992-01-15 EP disclosed
EP-0298553-A1 Methylene phosphonoalkylphosphinates, pharmaceutical compositions, and methods for treating abnormal calcium and phosphate metabolism Norwich Eaton Pharmaceuticals, Inc. (US) 1989-01-11 EP disclosed