SCHEMBL9730756

SCHEMBL9730756

CCCC(CCNCCC(O)(P(=O)(O)O)P(=O)(O)O)c1ccccc1

nearest known ligand 0.56

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
FDPS P14324 20/20 0.56
GGPS1 O95749 2/20 0.36

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
SCHEMBL11519128 0.72 FDPS (0.61) FDPSGGPS1
SCHEMBL9500738 0.72 FDPS (1.00) FDPSGGPS1
SCHEMBL19066394 0.70 AOC3 (0.46)
SCHEMBL6045245 0.70 FDPS (0.46) FDPSGGPS1
SCHEMBL1263573 0.70 AOC3 (0.48)
SCHEMBL9499871 0.70 FDPS (1.00) FDPSGGPS1
SCHEMBL2043639 0.69 AOC3 (0.45)
SCHEMBL9394777 0.69 FDPS (1.00) FDPSGGPS1
SCHEMBL9276354 0.68 AOC3 (0.47)
SCHEMBL31115057 0.68 AOC3 (0.44)

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-5162310-A Calcium Metabolism Regulators CIBA-GEIGY CORPORATION (US) 1992-11-10 US disclosed