SCHEMBL514557

SCHEMBL514557

Cn1ccnc1CC(P(=O)(O)O)P(=O)(O)O

nearest known ligand 0.55

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
FDPS P14324 11/20 0.55
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
HTT P42858 1/20 0.39
TSHR P16473 1/20 0.36
OPRK1 P41145 1/20 0.36
TRPM5 Q9NZQ8 1/20 0.35
LPO P22079 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
SCHEMBL6743060 0.84 FDPS (0.45) FDPS
Zoledronic Acid Anhydrous SCHEMBL9850927 0.80 FDPS (0.60) FDPSMEN1KMT2A
Phosphoric Acid SCHEMBL28269754 0.77 FDPS (0.60) FDPSMEN1KMT2AHTTTSHR
Phosphoric Acid SCHEMBL4397370 0.77 FDPS (0.60) FDPSMEN1KMT2AHTTTSHR
SCHEMBL13916698 0.75 FDPS (0.44) FDPSMEN1KMT2AHTTTSHR
Methyl Phosphonate SCHEMBL2525334 0.75 FDPS (0.58) FDPSMEN1KMT2AHTTTSHR
SCHEMBL6242617 0.74 FDPS (0.45) FDPSMEN1KMT2ATSHROPRK1
SCHEMBL19182738 0.74 FDPS (0.57) FDPSMEN1KMT2AHTTTSHR
SCHEMBL3979171 0.74 FDPS (0.43) FDPSMEN1KMT2AHTTTSHR
SCHEMBL12158386 0.72 FDPS (0.44) FDPSMEN1KMT2ATSHROPRK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0854724-B1 METHOD OF TREATING THE NAVICULAR DISEASE IN HORSES NOVARTIS AG (CH) 2005-03-16 EP claimed
US-6255288-B1 THERAPY FOR BONE DISORDERS NOVARTIS CORPORATION 2001-07-03 US claimed
US-6057306-A ADMINISTERING BISPHOSPHONATES TO TREAT BONE DISEASE NOVARTIS CORPORATION (US) 2000-05-02 US claimed
EP-0854724-A1 METHOD OF TREATING THE NAVICULAR DISEASE IN HORSES Novartis AG (CH) 1998-07-29 EP claimed
WO-1997012619-A1 METHOD OF TREATING THE NAVICULAR DISEASE IN HORSES NOVARTIS AG (CH) 1997-04-10 WO claimed
EP-0600834-A1 Use of methanebisphosphonic acid derivatives for the manufacture of a medicament for fracture healing CIBA-GEIGY AG (CH) 1994-06-08 EP claimed
EP-0550385-A1 Oral pharmaceutical compositions containing derivatives of methane-diphosphonic acid and 18-crown-6 ethers CIBA-GEIGY AG (CH) 1993-07-07 EP claimed
US-5133972-A TOPICALLY ADMINISTRABLE PHARMACEUTICAL PREPARATIONS CIBA-GEIGY CORPORATION (US) 1992-07-28 US claimed
EP-0275821-B1 SUBSTITUTED ALKANEDIPHOSPHONIC ACIDS CIBA-GEIGY AG (CH) 1992-02-26 EP claimed
EP-0407344-A2 Pharmaceutical preparation for topical application CIBA-GEIGY AG (CH) 1991-01-09 EP claimed
EP-0275821-A1 Substituted alkanediphosphonic acids CIBA-GEIGY AG (CH) 1988-07-27 EP claimed
US-20130138221-A1 METHODS AND COMPOSITIONS FOR IMPROVING IMPLANT OSSEOINTEGRATION NOVARTIS AG (CH) 2013-05-30 US disclosed
US-20120027818-A1 BISPHOSPHONATE PRODUCT IN A CYCLOOLEFINIC POLYMER CONTAINER GLAUSCH ALEXANDRA (DE) 2012-02-02 US disclosed
US-8052987-B2 Intermittently administering a bisphosphonate to patient, wherein period between administrations of bisphosphonate is at least 6 months; treatment of osteoporosis NOVARTIS PHARMACEUTICALS CORPORATION (US) 2011-11-08 US disclosed
US-7932241-B2 Filling plastic container with bisphosphonate solution; heat sterilization NOVARTIS AG (CH) 2011-04-26 US disclosed
US-5133972-A TOPICALLY ADMINISTRABLE PHARMACEUTICAL PREPARATIONS CIBA-GEIGY CORPORATION (US) 1992-07-28 US disclosed
EP-0275821-B1 SUBSTITUTED ALKANEDIPHOSPHONIC ACIDS CIBA-GEIGY AG (CH) 1992-02-26 EP disclosed
EP-0407344-A2 Pharmaceutical preparation for topical application CIBA-GEIGY AG (CH) 1991-01-09 EP disclosed
US-4939130-A Substituted alkanediphosphonic acids and pharmaceutical use CIBA-GEIGY CORPORATION (US) 1990-07-03 US disclosed
EP-0275821-A1 Substituted alkanediphosphonic acids CIBA-GEIGY AG (CH) 1988-07-27 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-20120027818-A1 BISPHOSPHONATE PRODUCT IN A CYCLOOLEFINIC POLYMER CONTAINER PGD, RICTOR, PAICS FDPS 90/4885MEN1 249/4885KMT2A 4810/4885

“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.