SCHEMBL21751996

SCHEMBL21751996

CC(=O)N1c2ccc(OC3CC(OC4CCN(C(=O)O)CC4)C3)cc2Sc2cc([N+](=O)[O-])ccc21

nearest known ligand 0.58

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ SNCA P37840 5/20 0.58
▸ MAPT P10636 5/20 0.38
▸ KDM4E B2RXH2 2/20 0.38
▸ HTT P42858 1/20 0.37
▸ LMNA P02545 4/20 0.37
▸ TDP1 Q9NUW8 1/20 0.36
▸ SMN1; SMN2 Q16637 3/20 0.35
▸ ALDH1A1 P00352 2/20 0.35
▸ SLC6A2 P23975 1/20 0.34
▸ SLC6A4 P31645 1/20 0.34
▸ SLC6A3 Q01959 1/20 0.34
▸ GAA P10253 2/20 0.34
▸ MAPK1 P28482 1/20 0.34
▸ SLC6A9 P48067 2/20 0.33
▸ SLC6A5 Q9Y345 2/20 0.33

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
SCHEMBL21820325 0.89 SNCA (0.54) SNCAMAPTKDM4ELMNAALDH1A1
SCHEMBL26017756 0.89 SNCA (0.54) SNCAMAPTKDM4ELMNAALDH1A1
SCHEMBL21752087 0.85 SNCA (0.50) SNCAMAPTHTTLMNATDP1
SCHEMBL21771119 0.82 SNCA (0.71) SNCAMAPTKDM4EHTTLMNA
SCHEMBL21751950 0.79 SNCA (0.60) SNCAMAPTKDM4ELMNATDP1
SCHEMBL26037891 0.79 SNCA (0.60) SNCAMAPTKDM4ELMNATDP1
SCHEMBL26017855 0.79 SNCA (0.60) SNCAMAPTKDM4ELMNATDP1
SCHEMBL26017758 0.76 GPR119 (0.48) SNCAMAPTLMNAALDH1A1
SCHEMBL21752128 0.76 GPR119 (0.48) SNCAMAPTLMNAALDH1A1
SCHEMBL21751995 0.75 SNCA (1.00) SNCAMAPTKDM4EHTTLMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240091204-A1 MODULATORS OF ALPHA-SYNUCLEIN PROTEOLYSIS AND ASSOCIATED METHODS OF USE ARVINAS OPERATIONS, INC. 2024-03-21 — — US disclosed
US-11707452-B2 Modulators of alpha-synuclein proteolysis and associated methods of use ARVINAS OPERATIONS, INC. (US) 2023-07-25 — — US disclosed
EP-3841100-A1 PROTEOLYSIS TARGETING CHIMERIC (PROTAC) COMPOUND WITH E3 UBIQUITIN LIGASE BINDING ACTIVITY AND TARGETING ALPHA-SYNUCLEIN PROTEIN FOR TREATING NEURODEGENERATIVE DISEASES Arvinas Operations, Inc. (US) 2021-06-30 — — EP disclosed
US-20200085793-A1 MODULATORS OF ALPHA-SYNUCLEIN PROTEOLYSIS AND ASSOCIATED METHODS OF USE ARVINAS OPERATIONS, INC. 2020-03-19 — — US disclosed
WO-2020041331-A1 PROTEOLYSIS TARGETING CHIMERIC (PROTAC) COMPOUND WITH E3 UBIQUITIN LIGASE BINDING ACTIVITY AND TARGETING ALPHA-SYNUCLEIN PROTEIN FOR TREATING NEURODEGENERATIVE DISEASES ARVINAS OPERATIONS, INC. (US) 2020-02-27 — — WO 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 (3 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-20240091204-A1 MODULATORS OF ALPHA-SYNUCLEIN PROTEOLYSIS AND ASSOCIATED METHODS OF USE UCHL1, ADRM1, CRBN SNCA 8/4885MAPT 741/4885KDM4E 2704/4885
US-20200085793-A1 MODULATORS OF ALPHA-SYNUCLEIN PROTEOLYSIS AND ASSOCIATED METHODS OF USE UCHL1, ADRM1, CRBN SNCA 8/4885MAPT 741/4885KDM4E 2704/4885
US-11707452-B2 Modulators of alpha-synuclein proteolysis and associated methods of use UCHL1, ADRM1, CRBN SNCA 8/4885MAPT 741/4885KDM4E 2704/4885

“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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