SCHEMBL8025855

SCHEMBL8025855

CC(C)(Cc1ccccc1)OO

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.54
CYP2D6 P10635 1/20 0.54
SLC6A2 P23975 1/20 0.52
TAAR1 Q96RJ0 1/20 0.52
TRPA1 O75762 1/20 0.47
ALDH1A1 P00352 2/20 0.46
ALOX15 P16050 1/20 0.46
CYP2C9 P11712 2/20 0.45
CYP2C19 P33261 2/20 0.45
CYP1A2 P05177 2/20 0.45
SMN1; SMN2 Q16637 1/20 0.42
HIF1A Q16665 1/20 0.42
MMP8 P22894 2/20 0.41
PPARG P37231 1/20 0.41
PPARA Q07869 1/20 0.41
FDPS P14324 1/20 0.41
CYP3A4 P08684 2/20 0.41
CTSK P43235 1/20 0.39
RECQL P46063 1/20 0.39
TP53 P04637 1/20 0.39

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
SCHEMBL1157985 0.81 SLC6A2 (0.56) LMNACYP2D6SLC6A2TAAR1TRPA1
SCHEMBL3385591 0.81 SLC6A2 (0.56) LMNACYP2D6SLC6A2TAAR1TRPA1
SCHEMBL27904858 0.80 LMNA (0.52) LMNACYP2D6SLC6A2TAAR1TRPA1
SCHEMBL872871 0.79 SLC6A2 (0.54) LMNACYP2D6SLC6A2TAAR1TRPA1
SCHEMBL31166039 0.78 SLC6A2 (0.48) LMNACYP2D6SLC6A2TAAR1TRPA1
SCHEMBL97088 0.78 SLC6A2 (0.48) LMNACYP2D6SLC6A2TAAR1TRPA1
SCHEMBL7492795 0.77 SLC6A2 (0.52) LMNACYP2D6SLC6A2TAAR1TRPA1
SCHEMBL7929657 0.77 SLC6A2 (0.52) LMNACYP2D6SLC6A2TAAR1TRPA1
SCHEMBL313697 0.77 SLC6A2 (0.52) LMNACYP2D6SLC6A2TAAR1TRPA1
SCHEMBL1003604 0.77 CTSK (0.49) LMNACYP2D6SLC6A2TAAR1TRPA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11242296-B2 Decomposition of organic peroxides and hydrogen peroxide by the iron thiolates and related complexes NUTECH VENTURES (US) 2022-02-08 US disclosed
US-20200181038-A1 DECOMPOSITION OF ORGANIC PEROXIDES AND HYDROGEN PEROXIDE BY THE IRON THIOLATES AND RELATED COMPLEXES BOARD OF REGENTS OF THE UNIVERSITY OF NEBRASKA 2020-06-11 US disclosed
EP-0982395-A1 Hydroperoxides as perfumes Dragoco Gerberding & Co Aktiengesellschaft (DE) 2000-03-01 EP disclosed
EP-0363379-B1 PORPHYRINS, THEIR SYNTHESES AND USES THEREOF DOLPHIN DAVID H (CA) 1995-06-14 EP 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 (2 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-20200181038-A1 DECOMPOSITION OF ORGANIC PEROXIDES AND HYDROGEN PEROXIDE BY THE IRON THIOLATES AND RELATED COMPLEXES GPX4, LPO, CAT LMNA 4433/4885CYP2D6 2099/4885SLC6A2 3386/4885
US-11242296-B2 Decomposition of organic peroxides and hydrogen peroxide by the iron thiolates and related complexes GPX4, LPO, CAT LMNA 4433/4885CYP2D6 2099/4885SLC6A2 3386/4885

“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.