SCHEMBL13824693

SCHEMBL13824693

CCCCOC(=O)NCCCP(=O)(OCOC(=O)C(C)(C)C)OCOC(=O)C(C)(C)C

nearest known ligand 0.49

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ACHE P22303 14/20 0.49
BTN3A1 O00481 4/20 0.44

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
SCHEMBL2958738 0.78 ACHE (0.44) ACHE
SCHEMBL8591415 0.78 ACHE (0.64) ACHE
SCHEMBL11923116 0.76 ACHE (0.59) ACHE
SCHEMBL13824579 0.75 ACHE (0.64) ACHE
SCHEMBL8589912 0.75 ACHE (0.59) ACHE
SCHEMBL13824645 0.74 ACHE (0.58) ACHE
SCHEMBL18676835 0.74 ACHE (0.66) ACHE
SCHEMBL13186961 0.73 BTN3A1 (0.60) BTN3A1
SCHEMBL8590276 0.73 ACHE (0.66) ACHE
SCHEMBL1881136 0.73 ACHE (0.37) ACHEBTN3A1

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
WO-2012150866-A1 PHOSPHORIBOSYLTRANSFERASE INHIBITORS AND USES THEREOF INDUSTRIAL RESEARCH LIMITED (NZ) 2012-11-08 WO disclosed