SCHEMBL8991809

SCHEMBL8991809

Cc1cncn1CC(P(=O)(O)O)P(=O)(O)O

nearest known ligand 0.50

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
FDPS P14324 7/20 0.50
GGPS1 O95749 3/20 0.50
CYP19A1 P11511 1/20 0.36
CYP11B1 P15538 1/20 0.36
CYP11B2 P19099 1/20 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
SCHEMBL10147161 0.74 CYP19A1 (0.42) CYP19A1CYP11B1CYP11B2
SCHEMBL1028197 0.71 FDPS (0.58) FDPSGGPS1
SCHEMBL20702894 0.69 CYP1A2 (0.39) CYP19A1CYP11B1CYP11B2
SCHEMBL4262821 0.67 FDPS (0.62) FDPSGGPS1
SCHEMBL3986005 0.67 FDPS (0.51) FDPSGGPS1
SCHEMBL3976006 0.67 FDPS (1.00) FDPSGGPS1
SCHEMBL13031367 0.67 LMNA (0.43) CYP19A1CYP11B1CYP11B2
SCHEMBL2308094 0.66
SCHEMBL3980736 0.65 FDPS (0.54) FDPSGGPS1
SCHEMBL3979481 0.65 FDPS (0.49) FDPSGGPS1

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-0722268-A1 HERBICIDAL AZA BISPHOSPHONIC ACID COMPOSITIONS ZENECA LIMITED (GB) 1996-07-24 EP claimed
WO-1995010188-A2 HERBICIDAL AZA BISPHOSPHONIC ACID COMPOSITIONS ZENECA LIMITED (GB) 1995-04-20 WO claimed