SCHEMBL14228032

SCHEMBL14228032

O=NP(=O)(O)C(C[n+]1cccc(-c2ccc(F)c(F)c2)c1)P(=O)(O)O

nearest known ligand 0.52

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ GGPS1 O95749 18/20 0.52
▸ FDPS P14324 2/20 0.35
▸ PDPK1 O15530 1/20 0.32

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
SCHEMBL12060606 0.91 GGPS1 (0.59) GGPS1FDPS
SCHEMBL14199574 0.86 GGPS1 (0.54) GGPS1FDPS
SCHEMBL12060601 0.73 GGPS1 (0.83) GGPS1FDPS
SCHEMBL12060624 0.70 GGPS1 (0.57) GGPS1FDPS
SCHEMBL12436806 0.69 GGPS1 (0.65) GGPS1FDPS
SCHEMBL12060627 0.69 GGPS1 (0.56) GGPS1FDPS
SCHEMBL14199553 0.69 GGPS1 (0.75) GGPS1FDPS
SCHEMBL12060536 0.68 GGPS1 (0.72) GGPS1FDPS
SCHEMBL14199567 0.67 GGPS1 (0.61) GGPS1FDPS
SCHEMBL14199578 0.67 GGPS1 (0.53) GGPS1FDPS

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7358361-B2 Biophosphonate compounds and methods for bone resorption diseases, cancer, bone pain, immune disorders, and infectious diseases THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ILLINOIS (US) 2008-04-15 — — US disclosed
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