SCHEMBL17523118

SCHEMBL17523118

CC(C)OC1OC(CO)C(O)C(C)C1O

nearest known ligand 0.44

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 1/20 0.40
▸ THRB P10828 1/20 0.40
▸ CA1 P00915 1/20 0.40
▸ CA2 P00918 1/20 0.40
▸ CA9 Q16790 1/20 0.40
▸ TYR P14679 2/20 0.39
▸ POLB P06746 2/20 0.38
▸ KDM4E B2RXH2 1/20 0.38
▸ RECQL P46063 1/20 0.38
▸ BLM P54132 1/20 0.38
▸ L3MBTL1 Q9Y468 1/20 0.38
▸ MAPT P10636 1/20 0.37
▸ GAA P10253 1/20 0.36
▸ KDR P35968 1/20 0.36
▸ CD209 Q9NNX6 1/20 0.35
▸ LGALS8 O00214 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
SCHEMBL19229002 1.00 ALDH1A1 (0.40) ALDH1A1THRBCA1CA2CA9
SCHEMBL16678815 0.87 L3MBTL1 (0.49) ALDH1A1THRBCA1CA2CA9
SCHEMBL10388284 0.87 L3MBTL1 (0.49) ALDH1A1THRBCA1CA2CA9
SCHEMBL14690893 0.87 L3MBTL1 (0.49) ALDH1A1THRBCA1CA2CA9
SCHEMBL20027477 0.87 L3MBTL1 (0.49) ALDH1A1THRBCA1CA2CA9
SCHEMBL24943577 0.87 L3MBTL1 (0.49) ALDH1A1THRBCA1CA2CA9
SCHEMBL10388282 0.87 L3MBTL1 (0.49) ALDH1A1THRBCA1CA2CA9
SCHEMBL14690973 0.87 L3MBTL1 (0.49) ALDH1A1THRBCA1CA2CA9
SCHEMBL19770588 0.87 L3MBTL1 (0.49) ALDH1A1THRBCA1CA2CA9
SCHEMBL26727391 0.87 L3MBTL1 (0.49) ALDH1A1THRBCA1CA2CA9

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
WO-2021096811-A1 TUCARESOL DERIVATIVES AND USES THEREOF BEYONDSPRING PHARMACEUTICALS, INC. (US) 2021-05-20 — — WO disclosed
US-9868711-B2 Phenazine-3-one and phenothiazine-3-one derivatives for treatment of oxidative stress disorders BIOELECTRON TECHNOLOGY CORPORATION (US) 2018-01-16 — — US disclosed
US-9670170-B2 Resorufin derivatives for treatment of oxidative stress disorders BIOELECTRON TECHNOLOGY CORPORATION (US) 2017-06-06 — — US disclosed
US-20160039775-A1 RESORUFIN DERIVATIVES FOR TREATMENT OF OXIDATIVE STRESS DISORDERS PTC THERAPEUTICS, INC. 2016-02-11 — — 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-20160039775-A1 RESORUFIN DERIVATIVES FOR TREATMENT OF OXIDATIVE STRESS DISORDERS TXNRD2, NDUFAB1, NDUFAF1 ALDH1A1 445/4885THRB 2009/4885CA1 4824/4885

“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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