SCHEMBL7185620

SCHEMBL7185620

CC(C)C(C(C)C)(C(C(C)C)(C(C)C)P(=O)(O)O)P(=O)(O)O

nearest known ligand 0.40

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.40
FDPS P14324 4/20 0.39
CA2 P00918 2/20 0.35
LAP3 P28838 3/20 0.35
CA12 O43570 1/20 0.32
CA1 P00915 1/20 0.32
MMP1 P03956 1/20 0.32
MMP2 P08253 1/20 0.32
MMP9 P14780 1/20 0.32
MMP8 P22894 1/20 0.32
CA9 Q16790 1/20 0.32
ALDH1A1 P00352 1/20 0.32
CYP2C19 P33261 1/20 0.32
ANPEP P15144 3/20 0.31
ERAP1 Q9NZ08 1/20 0.31
PGK1 P00558 1/20 0.30
PGK2 P07205 1/20 0.30

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
SCHEMBL6291966 0.74 FDPS (0.36) FDPSLAP3ANPEPERAP1
SCHEMBL19211974 0.73 LMNA (0.40) LMNAFDPSCA2LAP3CA12
SCHEMBL12570890 0.73 LMNA (0.40) LMNAFDPSCA2LAP3CA12
SCHEMBL7962142 0.71 LMNA (0.45) LMNAFDPSCA2LAP3CA12
SCHEMBL2695219 0.71 LMNA (0.45) LMNAFDPSCA2LAP3ALDH1A1
SCHEMBL3888707 0.71 LMNA (0.45) LMNAFDPSCA2LAP3CA12
SCHEMBL1071976 0.71 LMNA (0.38) LMNAFDPSCA2LAP3CA12
SCHEMBL7511455 0.71 LMNA (0.45) LMNAFDPSCA2LAP3ALDH1A1
SCHEMBL12627372 0.71 LMNA (0.45) LMNAFDPSCA2LAP3CA12
SCHEMBL8382378 0.69 LMNA (0.50) LMNAFDPSCA2LAP3ALDH1A1

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-20030190530-A1 Lithium Secondary Battery NGK INSULATORS, LTD. (JP) 2003-10-09 US disclosed
EP-1202374-A1 LITHIUM SECONDARY CELL NGK INSULATORS, LTD. (JP) 2002-05-02 EP disclosed