SCHEMBL24087771

SCHEMBL24087771

O=C1OC(Cn2c(=O)n(CC3CSC(=O)O3)c(=O)n(CC3CSC(=O)O3)c2=O)CS1

nearest known ligand 0.54

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
TP53 P04637 1/20 0.54
HBB P68871 1/20 0.54
SMN1; SMN2 Q16637 1/20 0.54

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
SCHEMBL6706268 0.81 TP53 (0.50) TP53HBBSMN1; SMN2
SCHEMBL22252554 0.80 TSHR (0.53) TP53HBBSMN1; SMN2
SCHEMBL22252310 0.76 MGLL (0.35) TP53SMN1; SMN2
SCHEMBL20754783 0.74
SCHEMBL22272189 0.72
SCHEMBL22252579 0.71
Teroxirone SCHEMBL4472568 0.71 TP53 (1.00) TP53HBBSMN1; SMN2
Teroxirone SCHEMBL4932 0.71 TP53 (1.00) TP53HBBSMN1; SMN2
Teroxirone SCHEMBL4461477 0.71 TP53 (1.00) TP53HBBSMN1; SMN2
Teroxirone SCHEMBL2097375 0.71 TP53 (1.00) TP53HBBSMN1; SMN2

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
US-20210380553-A1 Method for the preparation of compounds with cyclic monothiocarbonate groups BASF SE (DE) 2021-12-09 US 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-20210380553-A1 Method for the preparation of compounds with cyclic monothiocarbonate groups C1R, C1S, H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16 TP53 2248/4885HBB 936/4885SMN1; SMN2 3651/4885

“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.