SCHEMBL29924249

SCHEMBL29924249

CC(C)(C)OC(=O)N1C[C@@H](COS(C)(=O)=O)[C@H](COS(C)(=O)=O)C1

nearest known ligand 0.48

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
NR1H2 P55055 1/20 0.48
PDE4B Q07343 2/20 0.39
USP2 O75604 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
GPR119 Q8TDV5 9/20 0.38
NAMPT P43490 1/20 0.38
MEN1 O00255 1/20 0.37
ALDH1A1 P00352 1/20 0.37
MAPT P10636 1/20 0.37
KMT2A Q03164 1/20 0.37
HPGD P15428 1/20 0.37

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
SCHEMBL30721764 1.00 NR1H2 (0.48) NR1H2PDE4BUSP2SMN1; SMN2GPR119
SCHEMBL16053073 1.00 NR1H2 (0.48) NR1H2PDE4BUSP2SMN1; SMN2GPR119
SCHEMBL17310897 1.00 NR1H2 (0.48) NR1H2PDE4BUSP2SMN1; SMN2GPR119
SCHEMBL16930998 0.93 NR1H2 (0.44) NR1H2PDE4BUSP2SMN1; SMN2GPR119
SCHEMBL4737272 0.93 NR1H2 (0.44) NR1H2PDE4BUSP2SMN1; SMN2GPR119
SCHEMBL1572930 0.93 NR1H2 (0.44) NR1H2PDE4BUSP2SMN1; SMN2GPR119
SCHEMBL16930999 0.93 NR1H2 (0.44) NR1H2PDE4BUSP2SMN1; SMN2GPR119
SCHEMBL30456208 0.93 NR1H2 (0.44) NR1H2PDE4BUSP2SMN1; SMN2GPR119
SCHEMBL29812758 0.93 NR1H2 (0.44) NR1H2PDE4BUSP2SMN1; SMN2GPR119
SCHEMBL19462434 0.93 NR1H2 (0.44) NR1H2PDE4BUSP2SMN1; SMN2GPR119

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
US-20240118281-A1 ANTICANCER COMPOUNDS AND USES THEREOF UNIVERSITY OF FLORIDA RESEARCH FOUNDATION, INCORPORATED (US) 2024-04-11 US disclosed
WO-2022150754-A2 ANTICANCER COMPOUNDS AND USES THEREOF UNIVERSITY OF FLORIDA RESEARCH FOUNDATION, INCORPORATED (US) 2022-07-14 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20240118281-A1 ANTICANCER COMPOUNDS AND USES THEREOF MKI67, TP53, PCNA NR1H2 2200/4885PDE4B 3770/4885USP2 3085/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.