SCHEMBL7652096

SCHEMBL7652096

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

nearest known ligand 0.65

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
FOLH1 Q04609 9/20 0.65
GRM3 Q14832 2/20 0.65
NAALAD2 Q9Y3Q0 1/20 0.65

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
SCHEMBL7605053 0.84 FOLH1 (0.62) FOLH1GRM3NAALAD2
SCHEMBL1374871 0.79 FOLH1 (0.71) FOLH1GRM3NAALAD2
SCHEMBL383173 0.79 FOLH1 (1.00) FOLH1GRM3NAALAD2
SCHEMBL16528703 0.79 FOLH1 (1.00) FOLH1GRM3NAALAD2
SCHEMBL16528808 0.79 FOLH1 (1.00) FOLH1GRM3NAALAD2
SCHEMBL4135913 0.79 GRM3 (1.00) FOLH1GRM3NAALAD2
SCHEMBL12118136 0.79 FOLH1 (0.65) FOLH1GRM3NAALAD2
SCHEMBL13472032 0.79 FOLH1 (0.65) FOLH1GRM3NAALAD2
SCHEMBL7605870 0.78 FOLH1 (0.59) FOLH1GRM3NAALAD2
SCHEMBL5053371 0.77 GRM3 (0.79) FOLH1GRM3NAALAD2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6413948-B1 CENTRAL NERVOUS SYSTEM DISORDERS GUILFORD PHARMACEUTICALS INC. 2002-07-02 US claimed