SCHEMBL9000195

SCHEMBL9000195

CCC(CC)(SCn1cncn1)P(=O)(O)O

nearest known ligand 0.51

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
FDPS P14324 1/20 0.51
EGLN3 Q9H6Z9 1/20 0.37
HDAC1 Q13547 1/20 0.33
HDAC6 Q9UBN7 1/20 0.33
HSP90AA1 P07900 1/20 0.33

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
SCHEMBL9000142 0.82 FDPS (0.49) FDPSEGLN3
SCHEMBL18210642 0.72 FDPS (0.42) FDPSEGLN3HSP90AA1
SCHEMBL9000200 0.70 FDPS (0.49) FDPSEGLN3HDAC1HDAC6HSP90AA1
SCHEMBL3155928 0.68 FDPS (1.00) FDPSEGLN3HDAC1HDAC6HSP90AA1
SCHEMBL3889472 0.67 FDPS (0.36) FDPS
SCHEMBL10925105 0.67 FDPS (0.45) FDPSEGLN3
SCHEMBL10959321 0.66 FDPS (0.56) FDPSEGLN3HDAC1HDAC6
SCHEMBL10626196 0.66 FDPS (0.70) FDPSEGLN3HSP90AA1
SCHEMBL7813444 0.66
SCHEMBL9000191 0.65 FDPS (0.43) FDPSEGLN3HDAC1HDAC6

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-0730408-A1 TRIAZOLE PHOSPHONATE PESTICIDES AgrEvo UK Limited (GB) 1996-09-11 EP disclosed
WO-1995014385-A1 TRIAZOLE PHOSPHONATE PESTICIDES AGREVO UK LIMITED (GB) 1995-06-01 WO disclosed