SCHEMBL28020232

SCHEMBL28020232

CCC(=O)ONC(=O)CS

nearest known ligand 0.42

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.42
HSD17B10 Q99714 1/20 0.42
MGAM O43451 1/20 0.32
GAA P10253 1/20 0.32
SI P14410 1/20 0.32
MGAM2 Q2M2H8 1/20 0.32
ALDH1A1 P00352 1/20 0.32
NAAA Q02083 1/20 0.30
MEN1 O00255 1/20 0.30
KMT2A Q03164 1/20 0.30
CTSD P07339 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
SCHEMBL4897752 0.83 KMT2A (0.39) TSHRHSD17B10MGAMGAASI
SCHEMBL14829167 0.77 ALDH1A1 (0.39) MGAMGAASIMGAM2ALDH1A1
SCHEMBL29071667 0.77 ALDH1A1 (0.32) HSD17B10MGAMGAASIMGAM2
SCHEMBL13268373 0.75
SCHEMBL23867785 0.74 ALDH1A1 (0.42) TSHRMGAMGAASIMGAM2
SCHEMBL3732050 0.74 ALDH1A1 (0.34) TSHRMGAMGAASIMGAM2
SCHEMBL27353580 0.73
SCHEMBL7797469 0.73 MGAM (0.42) TSHRHSD17B10MGAMGAASI
SCHEMBL5037696 0.73
SCHEMBL28414510 0.73 FFAR3 (0.33) TSHRHSD17B10MGAMGAASI

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-104768573-B Peptide is marked for 177 Lu that locus specificity uPAR is targetted TRT创新有限责任公司 2017-08-29 CN disclosed
CN-104768573-A 177-lu labeled peptide for site-specific uPAR-targeting RIKSHOSPITALET HF 2015-07-08 CN disclosed