SCHEMBL3357622

SCHEMBL3357622

O=P(O)(O)C(O)(Cc1ccc(-c2cccc(-c3ccccc3)c2)cc1)P(=O)(O)O

nearest known ligand 0.82

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
GGPS1 O95749 6/20 0.82
FDPS P14324 7/20 0.69
PTPN5 P54829 6/20 0.53
PTPN1 P18031 1/20 0.53
BTN3A1 O00481 1/20 0.46
PDE3A Q14432 1/20 0.46

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
SCHEMBL13431339 0.90 GGPS1 (1.00) GGPS1FDPSPTPN5PTPN1BTN3A1
SCHEMBL3356307 0.85 FDPS (0.71) GGPS1FDPSPTPN5BTN3A1PDE3A
SCHEMBL3846830 0.82 FDPS (1.00) GGPS1FDPSBTN3A1PDE3A
SCHEMBL30951466 0.79 GGPS1 (0.56) GGPS1FDPSPTPN5PTPN1
SCHEMBL13458845 0.78 GGPS1 (0.73) GGPS1FDPSPTPN5PTPN1
SCHEMBL3360700 0.78 GGPS1 (0.73) GGPS1FDPSPTPN5PTPN1
SCHEMBL13458846 0.78 GGPS1 (0.78) GGPS1FDPSPTPN5PTPN1BTN3A1
SCHEMBL23752150 0.74 GGPS1 (1.00) GGPS1FDPSPTPN5PTPN1
SCHEMBL10880584 0.73 FDPS (0.62) GGPS1FDPSPTPN1BTN3A1PDE3A
SCHEMBL271001 0.73 FDPS (1.00) GGPS1FDPSBTN3A1PDE3A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7687482-B2 Bisphosphonate compounds and methods THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ILLINOIS (US) 2010-03-30 US disclosed
US-7687482-B2 Bisphosphonate compounds and methods THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ILLINOIS (US) 2010-03-30 US disclosed
EP-2001486-A2 BISPHOSPHONATE COMPOUNDS AND METHODS THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ILLINOIS (US) 2008-12-17 EP disclosed
US-20070275931-A1 BISPHOSPHONATE COMPOUNDS AND METHODS THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ILLINOIS (US) 2007-11-29 US disclosed
US-20070275931-A1 BISPHOSPHONATE COMPOUNDS AND METHODS THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ILLINOIS (US) 2007-11-29 US disclosed
WO-2007109585-A2 BISPHOSPHONATE COMPOUNDS AND METHODS THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ILLINOIS (US) 2007-09-27 WO 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-20070275931-A1 BISPHOSPHONATE COMPOUNDS AND METHODS FDPS, GGPS1, FNTB GGPS1 2/4885FDPS 1/4885PTPN5 245/4885

“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.