SCHEMBL21292774

SCHEMBL21292774

CCS(=O)(=O)N1CCN(c2ccc(C=O)cc2)CC1

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 4/20 0.62
▸ TRIM24 O15164 1/20 0.58
▸ TRIM33 Q9UPN9 1/20 0.58
▸ KDM4E B2RXH2 3/20 0.56
▸ SMN1; SMN2 Q16637 2/20 0.56
▸ CYP17A1 P05093 2/20 0.52
▸ CYP21A2 P08686 2/20 0.52
▸ CYP11B1 P15538 2/20 0.52
▸ CYP3A4 P08684 2/20 0.52
▸ CYP19A1 P11511 1/20 0.52
▸ GAA P10253 1/20 0.47
▸ MMP13 P45452 2/20 0.47
▸ MMP14 P50281 2/20 0.47
▸ ADAMTS4 O75173 1/20 0.47
▸ HSD17B10 Q99714 1/20 0.46
▸ LMNA P02545 1/20 0.46
▸ HPGD P15428 1/20 0.46
▸ SLC6A2 P23975 1/20 0.46
▸ SLC6A4 P31645 1/20 0.46
▸ SLC6A3 Q01959 1/20 0.46

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
SCHEMBL23922817 0.85 ALDH1A1 (0.64) ALDH1A1TRIM24TRIM33KDM4ESMN1; SMN2
SCHEMBL2561698 0.82 TRIM24 (0.83) ALDH1A1TRIM24TRIM33KDM4ESMN1; SMN2
SCHEMBL3077544 0.82 TRIM24 (0.83) ALDH1A1TRIM24TRIM33KDM4ESMN1; SMN2
SCHEMBL12082286 0.81 KMT2A (0.67) ALDH1A1KDM4ESMN1; SMN2HSD17B10LMNA
SCHEMBL763179 0.79 KDM4E (0.59) ALDH1A1KDM4ESMN1; SMN2CYP17A1CYP21A2
SCHEMBL21484324 0.79 KDM4E (0.59) ALDH1A1KDM4ESMN1; SMN2CYP17A1CYP21A2
SCHEMBL900049 0.79 MAPT (0.61) ALDH1A1KDM4ESMN1; SMN2GAAHSD17B10
SCHEMBL27571160 0.79 ALDH1A1 (0.63) ALDH1A1KDM4ECYP17A1CYP21A2CYP11B1
SCHEMBL5356967 0.79 ALDH1A1 (0.66) ALDH1A1TRIM24TRIM33KDM4ESMN1; SMN2
SCHEMBL19634850 0.79 KMT2A (0.64) ALDH1A1KDM4EHSD17B10HPGDTSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3759075-B1 COMPOUNDS WITH FERROPTOSIS INDUCING ACTIVITY AND METHODS OF THEIR USE FERRO THERAPEUTICS INC (US) 2025-07-23 — — EP disclosed
US-20230039846-A1 COMPOUNDS AND METHODS OF USE FERRO THERAPEUTICS INC (US) 2023-02-09 — — US disclosed
US-20230039846-A1 COMPOUNDS AND METHODS OF USE FERRO THERAPEUTICS INC (US) 2023-02-09 — — US disclosed
CN-112041301-A Compounds having iron death inducing activity and methods of use thereof 费罗治疗公司 2020-12-04 — — CN disclosed
US-20190263802-A1 COMPOUNDS AND METHOD OF USE MOLECULAR SKIN THERAPEUTICS, INC. 2019-08-29 — — US disclosed
US-20190263802-A1 COMPOUNDS AND METHOD OF USE MOLECULAR SKIN THERAPEUTICS, INC. 2019-08-29 — — 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 (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-20230039846-A1 COMPOUNDS AND METHODS OF USE AIFM2, GPX4, GPX1 ALDH1A1 1254/4885TRIM24 4427/4885TRIM33 4752/4885
US-20190263802-A1 COMPOUNDS AND METHOD OF USE AIFM2, GPX4, GPX1 ALDH1A1 1190/4885TRIM24 4417/4885TRIM33 4792/4885

“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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