SCHEMBL8048478

SCHEMBL8048478

CCCP(=O)(O)CCC(CCC(=O)O)C(=O)O

nearest known ligand 0.76

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
FOLH1 Q04609 8/20 0.66
GRM3 Q14832 2/20 0.58
NAALAD2 Q9Y3Q0 1/20 0.53
GRM8 O00222 1/20 0.49
GRM6 O15303 1/20 0.49
GRM7 Q14831 1/20 0.49
GRM4 Q14833 1/20 0.49

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
SCHEMBL7609960 0.90 FOLH1 (0.62) FOLH1GRM3NAALAD2GRM8GRM6
SCHEMBL7608702 0.87 FOLH1 (0.72) FOLH1GRM3NAALAD2GRM8GRM6
SCHEMBL25500315 0.86 GRM3 (0.73) FOLH1GRM3NAALAD2
SCHEMBL1377526 0.86 GRM3 (0.73) FOLH1GRM3NAALAD2
SCHEMBL7605302 0.83 FOLH1 (0.66) FOLH1GRM3NAALAD2GRM8GRM6
SCHEMBL6037851 0.80 FOLH1 (0.72) FOLH1GRM3NAALAD2
SCHEMBL8469633 0.80 FOLH1 (0.62) FOLH1GRM3NAALAD2
SCHEMBL8060048 0.80 FOLH1 (1.00) FOLH1GRM3NAALAD2
SCHEMBL5060255 0.77 GRM3 (0.82) FOLH1GRM3NAALAD2
SCHEMBL340145 0.77 FFAR3 (0.55) GRM8GRM6GRM7GRM4

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
EP-1005348-A1 NAALADASE COMPOSITIONS AND METHODS FOR TREATING GLUTAMATE ABNORMALITY AND EFFECTING NEURONAL ACTIVITY IN ANIMALS GUILFORD PHARMACEUTICALS INC. (US) 2000-06-07 EP disclosed
EP-0949922-A1 PHARMACEUTICAL COMPOSITIONS AND METHODS OF TREATING COMPULSIVE DISORDERS USING NAALADASE INHIBITORS GUILFORD PHARMACEUTICALS INC. (US) 1999-10-20 EP disclosed
WO-1998013046-A1 NAALADASE COMPOSITIONS AND METHODS FOR TREATING GLUTAMATE ABNORMALITY AND EFFECTING NEURONAL ACTIVITY IN ANIMALS GUILFORD PHARMACEUTICALS INC. (US) 1998-04-02 WO disclosed
WO-1998013044-A1 PHARMACEUTICAL COMPOSITIONS AND METHODS OF TREATING COMPULSIVE DISORDERS USING NAALADASE INHIBITORS GUILFORD PHARMACEUTICALS INC. (US) 1998-04-02 WO disclosed