SCHEMBL21337022

SCHEMBL21337022

CCC(=O)NCCCC[C@H](NC(=O)NC(CCC(=O)O)C(=O)O)C(=O)O

nearest known ligand 0.74

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
FOLH1 Q04609 18/20 0.74
NAALAD2 Q9Y3Q0 2/20 0.60
RIMKLA Q8IXN7 1/20 0.60

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
SCHEMBL17119755 1.00 FOLH1 (0.74) FOLH1NAALAD2RIMKLA
SCHEMBL19840647 1.00 FOLH1 (0.74) FOLH1NAALAD2RIMKLA
SCHEMBL26849279 0.95 FOLH1 (0.71) FOLH1NAALAD2RIMKLA
SCHEMBL30185955 0.95 FOLH1 (0.67) FOLH1NAALAD2RIMKLA
SCHEMBL25741232 0.95 FOLH1 (0.67) FOLH1NAALAD2RIMKLA
SCHEMBL21344719 0.90 FOLH1 (0.72) FOLH1NAALAD2RIMKLA
SCHEMBL18655461 0.88 FOLH1 (0.74) FOLH1NAALAD2RIMKLA
SCHEMBL18059393 0.88 FOLH1 (0.69) FOLH1NAALAD2RIMKLA
SCHEMBL18800235 0.87 FOLH1 (0.76) FOLH1NAALAD2RIMKLA
SCHEMBL23252356 0.87 FOLH1 (0.67) FOLH1NAALAD2RIMKLA

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
EP-3536345-A1 METAL/RADIOMETAL-LABELED PSMA INHIBITORS FOR PSMA-TARGETED IMAGING AND RADIOTHERAPY The Johns Hopkins University (US) 2019-09-11 EP disclosed