SCHEMBL24852792

SCHEMBL24852792

COc1cc(S(C)(=O)=O)ccc1N(CC(=O)O)C(=O)OC(C)(C)C

nearest known ligand 0.46

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ KEAP1 Q14145 13/20 0.46
▸ NFE2L2 Q16236 13/20 0.46
▸ SMN1; SMN2 Q16637 1/20 0.43
▸ ALDH1A1 P00352 1/20 0.41
▸ LMNA P02545 2/20 0.38
▸ ADRA2A P08913 1/20 0.38
▸ CYP2D6 P10635 1/20 0.38
▸ CYP2C9 P11712 1/20 0.38
▸ DRD2 P14416 1/20 0.38
▸ TSHR P16473 1/20 0.38
▸ DRD3 P35462 1/20 0.38
▸ HTR2B P41595 1/20 0.38
▸ STAT6 P42226 1/20 0.38
▸ KCNH2 Q12809 1/20 0.38
▸ BLM P54132 1/20 0.37

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
SCHEMBL30295720 1.00 KEAP1 (0.46) KEAP1NFE2L2SMN1; SMN2ALDH1A1LMNA
SCHEMBL31363146 0.85 KMT2A (0.41) KEAP1NFE2L2SMN1; SMN2ALDH1A1LMNA
SCHEMBL29811519 0.85 SMN1; SMN2 (0.40) KEAP1NFE2L2SMN1; SMN2LMNAADRA2A
SCHEMBL23144640 0.85 SMN1; SMN2 (0.40) KEAP1NFE2L2SMN1; SMN2LMNAADRA2A
SCHEMBL24035759 0.81 GAA (0.41) KEAP1NFE2L2SMN1; SMN2ALDH1A1LMNA
SCHEMBL29184902 0.80 KEAP1 (0.36) KEAP1NFE2L2ALDH1A1TSHR
SCHEMBL4841484 0.80 KMT2A (0.43) SMN1; SMN2LMNATSHR
SCHEMBL24035257 0.80 KEAP1 (0.41) KEAP1NFE2L2SMN1; SMN2
SCHEMBL31363153 0.76 SMN1; SMN2 (0.43) SMN1; SMN2ALDH1A1LMNAADRA2ACYP2D6
SCHEMBL4842133 0.75 SMN1; SMN2 (0.38) KEAP1NFE2L2SMN1; SMN2

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-11807644-B2 Methods and compounds for restoring mutant p53 function PMV PHARMACEUTICALS, INC. (US) 2023-11-07 — — US disclosed
US-11807644-B2 Methods and compounds for restoring mutant p53 function PMV PHARMACEUTICALS, INC. (US) 2023-11-07 — — US disclosed
CN-116710430-A Methods and compounds for restoring mutant p53 function 皮姆维制药公司 2023-09-05 — — CN disclosed
US-20230002403-A1 METHODS AND COMPOUNDS FOR RESTORING MUTANT p53 FUNCTION PMV PHARMACEUTICALS, INC. 2023-01-05 — — 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-20230002403-A1 METHODS AND COMPOUNDS FOR RESTORING MUTANT p53 FUNCTION TP53, TP53BP1, HRAS KEAP1 1356/4885NFE2L2 884/4885SMN1; SMN2 3494/4885
US-11807644-B2 Methods and compounds for restoring mutant p53 function TP53, TP53BP1, HRAS KEAP1 1356/4885NFE2L2 884/4885SMN1; SMN2 3494/4885

“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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