SCHEMBL4946206

SCHEMBL4946206

CC1(CCOP(=O)(OCCC2(C)CO2)OP(=O)(O)OP(=O)(O)O)CO1

nearest known ligand 0.39

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
BTN3A1 O00481 3/20 0.39
MVD P53602 2/20 0.32
FNTA P49354 3/20 0.31
PGGT1B P53609 2/20 0.31
FNTB P49356 1/20 0.31

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
SCHEMBL2034253 0.89 BTN3A1 (0.47) BTN3A1MVDFNTAPGGT1BFNTB
SCHEMBL2034053 0.89 BTN3A1 (0.50) BTN3A1MVDFNTAPGGT1BFNTB
SCHEMBL4946200 0.83 BTN3A1 (0.40) BTN3A1MVD
SCHEMBL2996800 0.79 BTN3A1 (0.47) BTN3A1MVDFNTAPGGT1BFNTB
SCHEMBL2978878 0.79 BTN3A1 (0.33) BTN3A1
SCHEMBL3005883 0.78 BTN3A1 (0.46) BTN3A1MVDFNTAPGGT1BFNTB
SCHEMBL2995236 0.77 BTN3A1 (0.45) BTN3A1MVDFNTAFNTB
SCHEMBL2995155 0.77 BTN3A1 (0.45) BTN3A1MVDFNTAFNTB
SCHEMBL2999121 0.77 BTN3A1 (0.45) BTN3A1MVDFNTAFNTB
SCHEMBL2993317 0.77 BTN3A1 (0.45) BTN3A1MVDFNTAFNTB

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
US-7432253-B2 Phosphoepoxides, method for making same and uses INSTITUT NATIONAL DE LA SANTE ET DE LA RECHERCHE MEDICALE (FR) 2008-10-07 US disclosed
US-7101711-B1 Phosphoepoxides, method for making same and uses INSTITUT NATIONAL DE LA SANTA ET DE LA RECHERCHE MEDICALE (FR) 2006-09-05 US disclosed