SCHEMBL24926359

SCHEMBL24926359

CN(C)CC(=O)NC(C)(C)I

nearest known ligand 0.33

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
HDAC3 O15379 1/20 0.33
HDAC1 Q13547 1/20 0.33
HDAC2 Q92769 1/20 0.33
HDAC6 Q9UBN7 1/20 0.33
MAPT P10636 1/20 0.33
LMNA P02545 1/20 0.33
ALDH1A1 P00352 2/20 0.32
POLB P06746 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.30

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
SCHEMBL2733235 0.83 POLB (0.42) HDAC3HDAC1HDAC2HDAC6MAPT
SCHEMBL4577905 0.80 ALDH1A1 (0.35) HDAC3HDAC1HDAC2HDAC6MAPT
SCHEMBL4577910 0.76 ALDH1A1 (0.35) HDAC3HDAC1HDAC2HDAC6MAPT
SCHEMBL12259749 0.73
SCHEMBL19918802 0.71
SCHEMBL11985623 0.70 ALDH1A1 (0.39) ALDH1A1
SCHEMBL23571957 0.70 TSHR (0.41) MAPTLMNAALDH1A1POLB
SCHEMBL27420042 0.69 POLB (0.38) HDAC3HDAC1HDAC2HDAC6MAPT
SCHEMBL4823707 0.68 POLB (0.36) HDAC3HDAC1HDAC2HDAC6MAPT
SCHEMBL15125093 0.68 ALDH1A1 (0.39) MAPTLMNAALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230031954-A1 TETRACYCLINE COMPOUNDS AND METHODS OF TREATMENT TETRAPHASE PHARMACEUTICALS, INC. 2023-02-02 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-20230031954-A1 TETRACYCLINE COMPOUNDS AND METHODS OF TREATMENT MCL1, ABL1, MALT1 HDAC3 102/4885HDAC1 91/4885HDAC2 148/4885

“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.