SCHEMBL19355274

SCHEMBL19355274

CN[C@@H](C)C(=O)N[C@@H](C)C=O

nearest known ligand 0.31

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
CTSS P25774 1/20 0.31
PAX8 Q06710 1/20 0.30

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
SCHEMBL21549702 1.00 CTSS (0.31) CTSSPAX8
SCHEMBL13857686 0.80 ALDH1A1 (0.32) CTSS
SCHEMBL23221216 0.78
SCHEMBL19355270 0.78
SCHEMBL17992737 0.77 PAX8 (0.31) PAX8
SCHEMBL10073576 0.77 PAX8 (0.45) PAX8
SCHEMBL12251245 0.77 PAX8 (0.45) PAX8
SCHEMBL10072974 0.77 PAX8 (0.45) PAX8
SCHEMBL22525115 0.75 CA12 (0.39)
SCHEMBL13050528 0.75 CA12 (0.39)

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-2017153432-A1 A NEW UNIVERSAL METHOD TO CAPTURE AND ANALYZE ADCS FOR CHARACTERIZATION OF DRUG DISTRIBUTION AND THE DRUG-TO-ANTIBODY RATIO IN BIOLOGICAL SAMPLES PIERRE FABRE MEDICAMENT (FR) 2017-09-14 WO disclosed