SCHEMBL2990948

SCHEMBL2990948

CCCC(CCC)CC(=O)CP(=O)(O)O

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FDPS P14324 6/20 0.46
METAP1 P53582 2/20 0.41
MEN1 O00255 1/20 0.36
LMNA P02545 1/20 0.36
HPGD P15428 1/20 0.36
TSHR P16473 1/20 0.36
BLM P54132 1/20 0.36
KMT2A Q03164 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
LAP3 P28838 2/20 0.35
GRIN2D O15399 1/20 0.35
GRIN3B O60391 1/20 0.35
GRIN1 Q05586 1/20 0.35
GRIN2A Q12879 1/20 0.35
GRIN2B Q13224 1/20 0.35
GRIN2C Q14957 1/20 0.35
GRIN3A Q8TCU5 1/20 0.35
CYP2D6 P10635 1/20 0.35
CYP2C9 P11712 1/20 0.35
CYP2C19 P33261 1/20 0.35

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
SCHEMBL712617 0.83 LAP3 (0.39) FDPSMEN1LMNAHPGDTSHR
SCHEMBL7948679 0.82 FDPS (0.45) FDPSMETAP1MEN1LMNAHPGD
SCHEMBL3737096 0.75 FDPS (0.48) FDPSMETAP1LAP3
SCHEMBL9547924 0.75 FDPS (0.48) FDPSMETAP1LAP3
SCHEMBL2987743 0.74 FDPS (0.44) FDPSMETAP1TSHRTDP1LAP3
SCHEMBL2982465 0.73 TDP1 (0.42) MEN1LMNAHPGDTSHRBLM
SCHEMBL8895680 0.73 CES2 (0.39) FDPSTSHRTDP1
SCHEMBL11871361 0.72 CYP3A4 (0.33) FDPSTSHRTDP1
SCHEMBL3741705 0.72 FDPS (0.52) FDPSLAP3
SCHEMBL12559017 0.71 CYP2C19 (0.43) FDPSMETAP1TSHRTDP1CYP2C19

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8962192-B2 Nonaqueous electrolytic solution and nonaqueous electrolyte battery MITSUBISHI CHEMICAL CORPORATION (JP) 2015-02-24 US disclosed
US-8574757-B2 Nonaqueous electrolytic solution and nonaqueous electrolyte battery MITSUBISHI CHEMICAL CORPORATION (JP) 2013-11-05 US disclosed
US-20120264011-A1 NONAQUEOUS ELECTROLYTIC SOLUTION AND NONAQUEOUS ELECTROLYTE BATTERY MITSUBISHI CHEMICAL CORPORATION (JP) 2012-10-18 US disclosed
US-20100035147-A1 NONAQUEOUS ELECTROLYTIC SOLUTION AND NONAQUEOUS ELECTROLYTE BATTERY MITSUBISHI CHEMICAL CORPORATION (JP) 2010-02-11 US disclosed