SCHEMBL21771119

SCHEMBL21771119

CC(=O)N1c2ccc(OC3CCC3)cc2Sc2cc([N+](=O)[O-])ccc21

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SNCA P37840 5/20 0.71
▸ MAPT P10636 5/20 0.42
▸ KDM4E B2RXH2 1/20 0.42
▸ SMN1; SMN2 Q16637 3/20 0.39
▸ LMNA P02545 2/20 0.39
▸ CYP19A1 P11511 4/20 0.38
▸ GAA P10253 1/20 0.38
▸ MAPK1 P28482 1/20 0.38
▸ TDP1 Q9NUW8 1/20 0.38
▸ NPC1 O15118 1/20 0.38
▸ POLB P06746 1/20 0.38
▸ RAB9A P51151 1/20 0.38
▸ MEN1 O00255 1/20 0.38
▸ PTGES O14684 1/20 0.38
▸ ALDH1A1 P00352 1/20 0.38
▸ CYP1A2 P05177 1/20 0.38
▸ CYP3A4 P08684 1/20 0.38
▸ CYP2D6 P10635 1/20 0.38
▸ ALOX15 P16050 1/20 0.38
▸ TSHR P16473 1/20 0.38

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
SCHEMBL21751995 0.83 SNCA (1.00) SNCAMAPTKDM4ESMN1; SMN2LMNA
SCHEMBL1208152 0.82 SNCA (0.86) SNCAMAPTKDM4ESMN1; SMN2LMNA
SCHEMBL29850622 0.82 SNCA (0.86) SNCAMAPTKDM4ESMN1; SMN2LMNA
SCHEMBL21751996 0.82 SNCA (0.58) SNCAMAPTKDM4ESMN1; SMN2LMNA
SCHEMBL21751950 0.82 SNCA (0.60) SNCAMAPTKDM4ESMN1; SMN2LMNA
SCHEMBL26037891 0.82 SNCA (0.60) SNCAMAPTKDM4ESMN1; SMN2LMNA
SCHEMBL26017855 0.82 SNCA (0.60) SNCAMAPTKDM4ESMN1; SMN2LMNA
SCHEMBL21820325 0.79 SNCA (0.54) SNCAMAPTKDM4ELMNAALDH1A1
SCHEMBL26017756 0.79 SNCA (0.54) SNCAMAPTKDM4ELMNAALDH1A1
SCHEMBL21820208 0.79 SNCA (0.51) SNCAMAPTKDM4ESMN1; SMN2LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11707452-B2 Modulators of alpha-synuclein proteolysis and associated methods of use ARVINAS OPERATIONS, INC. (US) 2023-07-25 — — 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 (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-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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