SCHEMBL9166642

SCHEMBL9166642

O=P(O)(O)C(O)(CC1CCCC1CCCS)P(=O)(O)O

nearest known ligand 0.41

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
FDPS P14324 4/20 0.41
PDE3A Q14432 1/20 0.31
GGPS1 O95749 1/20 0.30

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
SCHEMBL9240376 0.97 FDPS (0.44) FDPSPDE3AGGPS1
SCHEMBL9239082 0.90 FDPS (0.42) FDPSPDE3A
SCHEMBL9244507 0.76 FDPS (0.45) FDPSPDE3AGGPS1
SCHEMBL9435895 0.76 FDPS (0.49) FDPSPDE3AGGPS1
SCHEMBL9166648 0.73
SCHEMBL9241339 0.73 FDPS (0.49) FDPSPDE3AGGPS1
SCHEMBL20573016 0.73 FDPS (0.45) FDPSPDE3AGGPS1
SCHEMBL9246112 0.72 FDPS (0.41) FDPSPDE3A
SCHEMBL28665429 0.71 FDPS (0.44) FDPSPDE3AGGPS1
SCHEMBL20572945 0.70 FDPS (0.53) FDPSPDE3AGGPS1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0650361-A1 COMPOSITIONS FOR THE TREATMENT OF ARTHRITIS CONTAINING PHOSPHONATES AND NSAIDS PROCTER & GAMBLE PHARMACEUTICALS, INC. (US) 1995-05-03 EP disclosed
WO-1994000130-A1 COMPOSITIONS FOR THE TREATMENT OF ARTHRITIS CONTAINING PHOSPHONATES AND NSAIDS PROCTER & GAMBLE PHARMACEUTICALS, INC. (US) 1994-01-06 WO disclosed