SCHEMBL6666090

SCHEMBL6666090

O=P(O)(O)C(O)(CCCCl)P(=O)(O)O

nearest known ligand 0.60

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
FDPS P14324 20/20 0.60
PDE3A Q14432 3/20 0.60
GGPS1 O95749 7/20 0.58
LMNA P02545 1/20 0.52
ADRB3 P13945 1/20 0.52
PDE4D Q08499 1/20 0.52
AGTR1 P30556 1/20 0.41
OPRM1 P35372 1/20 0.41

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
SCHEMBL6666352 0.91 FDPS (0.63) FDPSPDE3AGGPS1LMNAADRB3
SCHEMBL6668154 0.91 FDPS (0.63) FDPSPDE3AGGPS1LMNAADRB3
SCHEMBL6669214 0.84 FDPS (0.56) FDPSPDE3AGGPS1LMNAADRB3
SCHEMBL15452862 0.84 FDPS (0.76) FDPSPDE3AGGPS1LMNAADRB3
SCHEMBL9313278 0.81 FDPS (0.77) FDPSPDE3AGGPS1LMNAADRB3
SCHEMBL9313105 0.79 FDPS (0.74) FDPSPDE3AGGPS1LMNAADRB3
SCHEMBL24616673 0.78 FDPS (0.68) FDPSPDE3AGGPS1LMNAADRB3
SCHEMBL10705729 0.77 FDPS (0.62) FDPSPDE3AGGPS1LMNAADRB3
SCHEMBL11066276 0.76 FDPS (0.35) FDPSPDE3AGGPS1LMNAADRB3
Alendronic Acid SCHEMBL6270347 0.75 FDPS (1.00) FDPSPDE3AGGPS1LMNAADRB3

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