Ergosterol Peroxide

Ergosterol Peroxide

SCHEMBL17368944

CC(C)C(C)/C=C/C(C)C1CCC2C34C=CC5(CC(O)CC[C@]5(C)C3CC[C@]12C)OO4

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PLA2G1B P04054 2/20 0.46
▸ ALDH1A1 P00352 2/20 0.41
▸ ALOX15 P16050 2/20 0.41
▸ MAPT P10636 1/20 0.41
▸ MEN1 O00255 1/20 0.36
▸ NR1I2 O75469 1/20 0.36
▸ PGR P06401 1/20 0.36
▸ KMT2A Q03164 1/20 0.36
▸ VDR P11473 1/20 0.36
▸ LMNA P02545 2/20 0.35
▸ CYP3A4 P08684 2/20 0.35
▸ AR P10275 1/20 0.35
▸ TSHR P16473 1/20 0.35
▸ CYP2C9 P11712 1/20 0.35
▸ CYP2C19 P33261 1/20 0.35
▸ USP2 O75604 1/20 0.35
▸ ABCB11 O95342 1/20 0.35
▸ ESR1 P03372 1/20 0.35
▸ HSPD1 P10809 1/20 0.35
▸ PTGS1 P23219 1/20 0.35

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
Ergosterol Peroxide SCHEMBL14067806 1.00 PLA2G1B (0.46) PLA2G1BALDH1A1ALOX15MAPTMEN1
Ergosterol Peroxide SCHEMBL4537649 1.00 PLA2G1B (0.46) PLA2G1BALDH1A1ALOX15MAPTMEN1
Ergosterol Peroxide SCHEMBL3281353 1.00 PLA2G1B (0.46) PLA2G1BALDH1A1ALOX15MAPTMEN1
Ergosterol Peroxide SCHEMBL3276091 1.00 PLA2G1B (0.46) PLA2G1BALDH1A1ALOX15MAPTMEN1
Ergosterol Peroxide SCHEMBL19715992 1.00 PLA2G1B (0.46) PLA2G1BALDH1A1ALOX15MAPTMEN1
SCHEMBL30249089 0.86 ALDH1A1 (0.35) PLA2G1BALDH1A1ALOX15MAPTMEN1
SCHEMBL16152196 0.79 PLA2G1B (0.55) PLA2G1BALDH1A1ALOX15MAPTMEN1
SCHEMBL8408231 0.79 PLA2G1B (0.55) PLA2G1BALDH1A1ALOX15MAPTMEN1
SCHEMBL30653161 0.79 PLA2G1B (0.55) PLA2G1BALDH1A1ALOX15MAPTMEN1
SCHEMBL4535338 0.69 ALDH1A1 (0.43) PLA2G1BALDH1A1ALOX15MAPTMEN1

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-20150374718-A1 Zhankuic Acid A and Analogs thereof and Their Use as an Anti-Inflammatory Agent NATIONAL CHENG KUNG UNIVERSITY (TW) 2015-12-31 — — US disclosed
US-20150374718-A1 Zhankuic Acid A and Analogs thereof and Their Use as an Anti-Inflammatory Agent NATIONAL CHENG KUNG UNIVERSITY (TW) 2015-12-31 — — 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-20150374718-A1 Zhankuic Acid A and Analogs thereof and Their Use as an Anti-Inflammatory Agent CD14, LY96, TLR4 PLA2G1B 1563/4885ALDH1A1 4498/4885ALOX15 2295/4885

“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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