SCHEMBL5155756

SCHEMBL5155756

CCOP(=O)(OCC)C(Nc1ncccc1O)P(=O)(OCC)OCC

nearest known ligand 0.47

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
FDPS P14324 5/20 0.47
PTPN2 P17706 1/20 0.43
PTPN1 P18031 1/20 0.43
NPC1 O15118 6/20 0.41
RAB9A P51151 6/20 0.41
TDP1 Q9NUW8 1/20 0.40
POLB P06746 1/20 0.40
NR0B1 P51843 1/20 0.39
ATM Q13315 1/20 0.39
TSHR P16473 1/20 0.38
HTT P42858 1/20 0.37
CGAS Q8N884 1/20 0.37

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
SCHEMBL8166679 0.84 FDPS (0.62) FDPSNPC1RAB9APOLBTSHR
SCHEMBL7784728 0.80 NPC1 (0.49) FDPSNPC1RAB9A
SCHEMBL7790447 0.77 FDPS (0.69) FDPSNPC1RAB9ANR0B1
SCHEMBL7793553 0.77 GRM5 (0.50)
SCHEMBL5360999 0.75 FDPS (0.58) FDPSPOLBHTT
SCHEMBL7790467 0.75 POLB (0.40) NPC1RAB9APOLBHTT
SCHEMBL8165471 0.74 FDPS (0.68) FDPSNPC1RAB9AATMTSHR
SCHEMBL5366533 0.71 FDPS (0.59) FDPSNPC1RAB9APOLBTSHR
SCHEMBL7793634 0.70 FDFT1 (0.42) PTPN2PTPN1POLB
SCHEMBL7793195 0.70 KDM4E (0.44) FDPSPTPN2PTPN1POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1328277-B1 BISPHOSPHONIC COMPOUNDS FOR STRENGTHENING OF CORTICAL BONE SCHERING AG (DE) 2007-02-14 EP claimed
US-20040014726-A1 Method for the preparation of a pharmaceutical composition, and its use SCHERING OY (FI) 2004-01-22 US claimed
EP-0762883-B1 PYRIDYLBISPHOSPHONATES FOR USE AS A THERAPEUTICAL AGENT LEIRAS OY (FI) 2001-11-14 EP claimed
EP-0762883-A1 PYRIDYLBISPHOSPHONATES FOR USE AS A THERAPEUTICAL AGENT LEIRAS OY (FI) 1997-03-19 EP claimed
WO-1995033466-A1 PYRIDYLBISPHOSPHONATES FOR USE AS A THERAPEUTICAL AGENT LEIRAS OY (FI) 1995-12-14 WO claimed
EP-1328277-B1 BISPHOSPHONIC COMPOUNDS FOR STRENGTHENING OF CORTICAL BONE SCHERING AG (DE) 2007-02-14 EP disclosed
US-20040014726-A1 Method for the preparation of a pharmaceutical composition, and its use SCHERING OY (FI) 2004-01-22 US disclosed
EP-1328277-A1 METHOD FOR THE PREPARATION OF A PHARMACEUTICAL COMPOSITION, AND ITS USE Schering Oy (FI) 2003-07-23 EP disclosed
WO-2002034269-A1 METHOD FOR THE PREPARATION OF A PHARMACEUTICAL COMPOSITION, AND ITS USE SCHERING OY (FI) 2002-05-02 WO disclosed
EP-0762883-B1 PYRIDYLBISPHOSPHONATES FOR USE AS A THERAPEUTICAL AGENT LEIRAS OY (FI) 2001-11-14 EP disclosed
US-6083938-A TREATING BONE DISEASES SELECTED FROM THE GROUP CONSISTING OF OSTEOLYTIC BONE DISEASES DUE TO MALIGNANCY, PAGET'S DISEASE AND PRIMARY AND SECONDARY OSTEOPOROSIS LEIRAS OY (FI) 2000-07-04 US disclosed
EP-0563107-B1 NOVEL METHYLENEBISPHOSPHONIC ACID DERIVATIVES LEIRAS OY (FI) 2000-05-03 EP disclosed
US-5866556-A BONE DISORDERS LEIRAS OY (FI) 1999-02-02 US disclosed
US-5393748-A Treating bone disorders, Paget* s disease, calcium metabolism disorders LEIRAS OY (FI) 1995-02-28 US 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-20040014726-A1 Method for the preparation of a pharmaceutical composition, and its use HRH3, ARG1, HRH4 FDPS 2403/4885PTPN2 2557/4885PTPN1 1900/4885

“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.