SCHEMBL8469633

SCHEMBL8469633

CC(CP(=O)(O)CCC(CCC(=O)O)C(=O)O)C(=O)O

nearest known ligand 0.77

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
FOLH1 Q04609 6/20 0.62
GRM3 Q14832 2/20 0.59
NAALAD2 Q9Y3Q0 1/20 0.54
CYP1A2 P05177 1/20 0.48
GCLC P48506 1/20 0.46

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
SCHEMBL14864542 0.87 GRM3 (0.69) FOLH1GRM3NAALAD2CYP1A2GCLC
SCHEMBL5053371 0.87 GRM3 (0.79) FOLH1GRM3NAALAD2CYP1A2
SCHEMBL7608702 0.81 FOLH1 (0.72) FOLH1GRM3NAALAD2
SCHEMBL8048478 0.80 FOLH1 (0.66) FOLH1GRM3NAALAD2
SCHEMBL6037851 0.78 FOLH1 (0.72) FOLH1GRM3NAALAD2
SCHEMBL20529841 0.78 GRM3 (0.81) FOLH1GRM3NAALAD2
SCHEMBL5051325 0.78 GRM3 (0.81) FOLH1GRM3NAALAD2
SCHEMBL7609960 0.77 FOLH1 (0.62) FOLH1GRM3NAALAD2
SCHEMBL8060048 0.77 FOLH1 (1.00) FOLH1GRM3NAALAD2
SCHEMBL1377526 0.77 GRM3 (0.73) FOLH1GRM3NAALAD2GCLC

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-1999033847-A1 PHOSPHINIC ALKANOIC ACID DERIVATIVES GUILFORD PHARMACEUTICALS INC. (US) 1999-07-08 WO claimed
WO-1999033847-A9 PHOSPHINIC ALKANOIC ACID DERIVATIVES GUILFORD PHARM INC (US) 1999-09-23 WO disclosed
WO-1999033847-A1 PHOSPHINIC ALKANOIC ACID DERIVATIVES GUILFORD PHARMACEUTICALS INC. (US) 1999-07-08 WO disclosed