SCHEMBL6663397

SCHEMBL6663397

CC(N)C(O)(P(=O)(O)O)P(=O)(O)OC(C)(C)C

nearest known ligand 0.38

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
FDPS P14324 3/20 0.38
LMNA P02545 1/20 0.34
LAP3 P28838 1/20 0.31

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
SCHEMBL5496511 0.79 FDPS (0.50) FDPSLMNALAP3
SCHEMBL3936724 0.79 FDPS (0.50) FDPSLMNALAP3
SCHEMBL5572484 0.77 FDPS (0.48) FDPSLMNALAP3
SCHEMBL8588658 0.75 GABRR1 (0.32) FDPSLMNA
SCHEMBL8619867 0.73 GABBR2 (0.33) FDPSLMNA
SCHEMBL4436425 0.69 FDPS (0.42) FDPSLMNALAP3
SCHEMBL13976468 0.67 LMNA (0.36) FDPSLMNA
SCHEMBL5059565 0.66 FDPS (0.46) FDPSLMNALAP3
SCHEMBL5318557 0.65 FDPS (0.46) FDPSLMNALAP3
SCHEMBL20892916 0.64 LAP3 (0.37) FDPSLMNALAP3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0831845-B1 DIPHOSPHONATE DERIVATIVES OF THERAPEUTIC AGENTS ELIZANOR BIOPHARMACEUTICALS IN (US) 2004-09-08 EP disclosed
US-5854227-A Therapeutic derivatives of diphosphonates ELIZANOR BIOPHARMACUETICALS, INC. 1998-12-29 US disclosed
WO-1996040156-A1 DIPHOSPHONATE DERIVATIVES OF THERAPEUTIC AGENTS ELIZANOR BIOPHARMACEUTICALS, INC. (US) 1996-12-19 WO disclosed