SCHEMBL6037818

SCHEMBL6037818

O=C(O)CCC(CCCCCCP(=O)(O)CC1CCCCC1)C(=O)O

nearest known ligand 0.47

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
FOLH1 Q04609 11/20 0.47
GRM3 Q14832 2/20 0.44
NAALAD2 Q9Y3Q0 1/20 0.41

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
SCHEMBL7608860 0.89 FOLH1 (0.55) FOLH1GRM3NAALAD2
SCHEMBL5057914 0.82 GRM3 (0.63) FOLH1GRM3NAALAD2
SCHEMBL10901126 0.77 LMNA (0.43)
SCHEMBL8063534 0.72 FOLH1 (0.58) FOLH1GRM3NAALAD2
SCHEMBL81046 0.72 KDM5A (0.38) FOLH1
SCHEMBL10348904 0.72 FOLH1 (0.80) FOLH1GRM3NAALAD2
SCHEMBL8065592 0.69 FOLH1 (0.50) FOLH1GRM3NAALAD2
SCHEMBL5087334 0.69 CA12 (0.38)
SCHEMBL12145013 0.68 GRM3 (0.73) FOLH1GRM3NAALAD2
SCHEMBL4627760 0.68 FOLH1 (0.74) FOLH1GRM3

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
WO-2006093991-A1 COMPOUNDS WHICH BIND PSMA AND USES THEREOF THE CLEVELAND CLINIC FOUNDATION (US) 2006-09-08 WO disclosed