SCHEMBL3380723

SCHEMBL3380723

CC(C)(N(Br)Br)P(=O)(O)O

nearest known ligand 0.43

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.43
FDPS P14324 1/20 0.41
PGK1 P00558 1/20 0.33
PGK2 P07205 1/20 0.33
CA2 P00918 1/20 0.32

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
SCHEMBL3379297 0.78 LMNA (0.39) LMNAFDPSPGK1PGK2
SCHEMBL3981963 0.75 LMNA (0.47) LMNAFDPSPGK1PGK2CA2
SCHEMBL1191901 0.71 LMNA (0.43) LMNAFDPSPGK1PGK2CA2
SCHEMBL27620863 0.67
SCHEMBL13645503 0.67 LMNA (0.39) LMNAFDPS
SCHEMBL335957 0.66
SCHEMBL3889334 0.65 LMNA (0.50) LMNAFDPSPGK1PGK2CA2
Phosphoric Acid SCHEMBL29620605 0.65 LMNA (0.42) LMNAFDPSPGK1PGK2CA2
SCHEMBL134918 0.63
SCHEMBL97568 0.63 LMNA (0.56) LMNAFDPSPGK1PGK2CA2

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
WO-2010017405-A1 METHODS AND COMPOSITIONS FOR THE TREATMENT OF PAIN HELLER ADAM (US) 2010-02-11 WO claimed
WO-2010017405-A1 METHODS AND COMPOSITIONS FOR THE TREATMENT OF PAIN HELLER ADAM (US) 2010-02-11 WO disclosed