SCHEMBL5973361

SCHEMBL5973361

CC(=O)OC[C@H]1OC(OC(C)=O)[C@H](N2C(=O)c3c(Cl)c(Cl)c(Cl)c(Cl)c3C2=O)[C@@H](OC(C)=O)[C@@H]1OC(C)=O

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ THRB P10828 2/20 0.46
▸ CYP2D6 P10635 1/20 0.46
▸ HSD17B10 Q99714 1/20 0.46
▸ CA2 P00918 7/20 0.43
▸ LMNA P02545 4/20 0.43
▸ TSHR P16473 1/20 0.43
▸ CA12 O43570 6/20 0.43
▸ CA1 P00915 6/20 0.43
▸ CA4 P22748 2/20 0.43
▸ CA5A P35218 2/20 0.43
▸ CA7 P43166 2/20 0.43
▸ CA5B Q9Y2D0 2/20 0.43
▸ CA9 Q16790 4/20 0.42
▸ SMN1; SMN2 Q16637 1/20 0.42
▸ HIF1A Q16665 1/20 0.42
▸ PTPN1 P18031 1/20 0.42
▸ P4HB P07237 1/20 0.41
▸ PDIA4 P13667 1/20 0.41
▸ PDIA3 P30101 1/20 0.41
▸ NR3C1 P04150 1/20 0.40

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
SCHEMBL25346209 1.00 THRB (0.46) THRBCYP2D6HSD17B10CA2LMNA
SCHEMBL16392960 1.00 THRB (0.46) THRBCYP2D6HSD17B10CA2LMNA
SCHEMBL5973544 0.93 THRB (0.45) THRBCYP2D6HSD17B10CA2LMNA
SCHEMBL18349742 0.91 THRB (0.42) THRBCYP2D6HSD17B10CA2LMNA
SCHEMBL1971892 0.90 THRB (0.40) THRBCYP2D6HSD17B10CA2LMNA
SCHEMBL16392969 0.88 TSHR (0.42) THRBCYP2D6HSD17B10CA2LMNA
SCHEMBL22559758 0.84 TSHR (0.39) THRBCYP2D6HSD17B10CA2LMNA
SCHEMBL16392956 0.84 TSHR (0.39) THRBCYP2D6HSD17B10CA2LMNA
SCHEMBL30180532 0.84 TSHR (0.39) THRBCYP2D6HSD17B10CA2LMNA
SCHEMBL25985225 0.84 TSHR (0.39) THRBCYP2D6HSD17B10CA2LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0970114-B1 NEOGLYCOPROTEINS NOVARTIS AG (CH) 2006-07-12 — — EP disclosed
US-6723831-B2 REMOVAL ANTIBODIES FROM BODY FLUIDS NOVARTIS AG (CH) 2004-04-20 — — US disclosed
US-20020164347-A1 Neoglycoproteins DUTHALER RUDOLF (CH) 2002-11-07 — — 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-20020164347-A1 Neoglycoproteins CD68, DNPEP, LNPEP THRB 3538/4885CYP2D6 4427/4885HSD17B10 4329/4885

“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.

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