SCHEMBL8778392

SCHEMBL8778392

C[n+]1cccnc1C(O)CC(P(=O)(O)O)P(=O)(O)O

nearest known ligand 0.39

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
FDPS P14324 10/20 0.39
HDAC8 Q9BY41 4/20 0.39
GGPS1 O95749 2/20 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
Hydrochloric Acid SCHEMBL8465519 1.00 FDPS (0.39) FDPSHDAC8GGPS1
Hydrochloric Acid SCHEMBL8468478 0.74 FDPS (0.49) FDPSHDAC8GGPS1
SCHEMBL8778336 0.74 FDPS (0.49) FDPSHDAC8GGPS1
Hydrochloric Acid SCHEMBL8467874 0.72 FDPS (0.40) FDPSHDAC8GGPS1
SCHEMBL8778420 0.72 FDPS (0.40) FDPSHDAC8GGPS1
Hydrochloric Acid SCHEMBL8468070 0.71 FDPS (0.36) FDPSGGPS1
SCHEMBL8778424 0.69 FDPS (0.33) FDPSGGPS1
Hydrochloric Acid SCHEMBL9163545 0.68 FDPS (0.39) FDPSHDAC8
SCHEMBL8778167 0.61 FDPS (0.50) FDPSHDAC8GGPS1
Hydrochloric Acid SCHEMBL8467219 0.61 FDPS (0.50) FDPSHDAC8GGPS1

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
EP-0648120-B1 USE OF PHOSPHONATES FOR THE TREATMENT OF OSTEOPOROSIS PROCTER & GAMBLE PHARMA (US) 1997-12-29 EP claimed