SCHEMBL25596648

SCHEMBL25596648

CCCNS(=O)(=O)N1CCN(C(C)(C)C)CC1

nearest known ligand 0.39

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CA1 P00915 1/20 0.39
KIT P10721 1/20 0.34
PPARA Q07869 2/20 0.32
TDP1 Q9NUW8 1/20 0.31

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
SCHEMBL20846776 0.84 ALDH1A1 (0.33)
SCHEMBL10281482 0.79 CA1 (0.43) CA1KITPPARATDP1
SCHEMBL28933820 0.79 CA1 (0.46) CA1KITPPARA
SCHEMBL16508745 0.79 CA1 (0.46) CA1KITPPARA
SCHEMBL20846775 0.75
SCHEMBL84444 0.74 POLB (0.41)
SCHEMBL16508792 0.74 CA12 (0.45) CA1
SCHEMBL5889230 0.69 CA1 (0.47) CA1PPARATDP1
SCHEMBL26214261 0.68 CHRM5 (0.44) KIT
SCHEMBL28869534 0.68 CA1 (0.50) CA1PPARATDP1

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-11673898-B2 Substituted inhibitors of menin-MLL and methods of use KURA ONCOLOGY, INC. (US) 2023-06-13 US disclosed
US-11649251-B2 Substituted inhibitors of menin-MLL and methods of use KURA ONCOLOGY, INC. (US) 2023-05-16 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-11649251-B2 Substituted inhibitors of menin-MLL and methods of use MLLT1, MEN1, MLLT3 CA1 2368/4885KIT 2572/4885PPARA 3242/4885
US-11673898-B2 Substituted inhibitors of menin-MLL and methods of use MLLT1, MEN1, MLLT3 CA1 1801/4885KIT 2072/4885PPARA 2792/4885

“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.