Ibandronic Acid

Ibandronic Acid

SCHEMBL1030766

CCCCCN(C)CCC(O)(P(=O)(O)O)P(=O)(O)O.[NaH]

nearest known ligand 0.97

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

FDPS

The experimentally established mechanism targets of Ibandronic Acid. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
FDPS known ✓ P14324 19/20 0.97
GGPS1 O95749 8/20 0.97
AGTR1 P30556 1/20 0.97
OPRM1 P35372 1/20 0.97
PDE3A Q14432 1/20 0.97
S1PR2 O95136 1/20 0.59
S1PR1 P21453 1/20 0.59
S1PR3 Q99500 1/20 0.59
S1PR5 Q9H228 1/20 0.59

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
Ibandronic Acid SCHEMBL3419518 1.00 FDPS (0.97) FDPSGGPS1AGTR1OPRM1PDE3A
Ibandronic Acid SCHEMBL1240197 0.98 FDPS (0.93) FDPSGGPS1AGTR1OPRM1PDE3A
Ibandronic Acid SCHEMBL365290 0.98 FDPS (0.93) FDPSGGPS1AGTR1OPRM1PDE3A
Ibandronic Acid SCHEMBL28564280 0.98 FDPS (0.93) FDPSGGPS1AGTR1OPRM1PDE3A
Ibandronic Acid SCHEMBL3415425 0.98 FDPS (0.93) FDPSGGPS1AGTR1OPRM1PDE3A
Ibandronic Acid SCHEMBL9183 0.98 FDPS (1.00) FDPSGGPS1AGTR1OPRM1PDE3A
Ibandronic Acid SCHEMBL5818379 0.98 FDPS (1.00) FDPSGGPS1AGTR1OPRM1PDE3A
Ibandronic Acid SCHEMBL3630021 0.97 FDPS (0.90) FDPSGGPS1AGTR1OPRM1PDE3A
Ibandronic Acid SCHEMBL3624745 0.97 FDPS (0.90) FDPSGGPS1AGTR1OPRM1PDE3A
Ibandronic Acid SCHEMBL3628878 0.97 FDPS (0.90) FDPSGGPS1AGTR1OPRM1PDE3A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110063939-B Hollow hydroxyapatite drug-loaded particle for shock wave mediated release and preparation method thereof 邢更彦 2021-08-17 CN claimed
CN-112891621-A Artificial bone material carrying anti-osteoporosis medicine and method for preparing artificial bone 中南大学湘雅医院 2021-06-04 CN claimed
CN-109999220-A The preparation method of fiber reinforced calcium orthophosphate base bone renovating material for 3D printing 西南交通大学 2019-07-12 CN claimed
CN-106511356-B A kind of ibandronic acid composition of sodium and preparation method thereof 南京恒生制药有限公司 2019-02-26 CN claimed
CN-106006593-B A kind of nano-calcium phosphate preparation method of simple and effective 西南交通大学 2018-08-17 CN claimed
CN-106511356-A Sodium ibandronate composition and preparation method thereof 南京恒生制药有限公司 2017-03-22 CN claimed
CN-106006593-A Simple and efficient preparation method of nano calcium phosphate 西南交通大学 2016-10-12 CN claimed
CN-103182099-B Porous active artificial bone and preparation method thereof SHENZHEN LANDO BIOMATERIALS CO LTD 2015-02-18 CN claimed
EP-1880744-B1 Bisphosphonic acids for the treatment and prevention of osteoporosis HOFFMANN LA ROCHE (CH) 2015-01-21 EP claimed
CN-102645513-B Method for determining sodion content in diphosphonic acid monosodium salt compound CHENGDU EASTON PHARMACEUTICAL 2014-07-16 CN claimed
CN-101279985-B Synthetic method of ibandronate SUZHOU HANDEPHARM TECHNOLOGY CO LTD 2012-09-05 CN claimed
CN-102645513-A Method for determining sodion content in diphosphonic acid monosodium salt compound CHENGDU EASTON PHARMACEUTICAL 2012-08-22 CN claimed
EP-1716161-B1 Ibandronic acid monosodium salt in the amorphous form ALCHYMARS S P A (IT) 2011-05-04 EP claimed
US-7723542-B2 Process for the preparation of alkyl- and aryl-diphosphonic acids and salts thereof TRIFARMA S.P.A. (IT) 2010-05-25 US claimed
CN-101279985-A Synthetic method of ibandronate SHENZHEN HANDEPHARM TECHNOLOGY (CN) 2008-10-08 CN claimed
CN-101117339-A Method for preparing sodium ibandronate crystal and hydrated crystal thereof CHONGQING SHENGHUAXI PHARMA CO (CN) 2008-02-06 CN claimed
CN-101022812-A Solid and crystalline ibandronate sodium and processes for preparation thereof TEVA PHARMA (IL) 2007-08-22 CN claimed
US-20070112197-A1 Process for the preparation of alkyl-and aryl-diphosphonic acids and salts thereof TRIFARMA S.P.A. (IT) 2007-05-17 US claimed
EP-1716161-A2 A PROCESS FOR THE PREPARATION OF ALKYL- AND ARYL-DIPHOSPHONIC ACIDS AND SALTS THEREOF Lyogen Limited (CY) 2006-11-02 EP claimed
WO-2005063779-A2 A PROCESS FOR THE PREPARATION OF ALKYL- AND ARYL-DIPHOSPHONIC ACIDS AND SALTS THEREOF LYOGEN LIMITED (CY) 2005-07-14 WO claimed

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-20070112197-A1 Process for the preparation of alkyl-and aryl-diphosphonic acids and salts thereof BPGM, P2RY6, P2RY12 FDPS 58/4885GGPS1 278/4885AGTR1 898/4885

“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.