SCHEMBL25514792

SCHEMBL25514792

CC(C)NC(=O)Cc1cn(C(C)C)nn1

nearest known ligand 0.41

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CCNE1 P24864 2/20 0.41
CDK2 P24941 2/20 0.41
VHL P40337 1/20 0.40
ALDH1A1 P00352 4/20 0.37
GAA P10253 1/20 0.37
MAPT P10636 1/20 0.37
HTT P42858 1/20 0.37
KDM4E B2RXH2 2/20 0.35
KMT2A Q03164 2/20 0.34
SMN1; SMN2 Q16637 1/20 0.33
LMNA P02545 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
MEN1 O00255 1/20 0.33
CYP19A1 P11511 1/20 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
SCHEMBL20997178 0.85 ALDH1A1 (0.41) CCNE1CDK2ALDH1A1GAAMAPT
SCHEMBL22916939 0.83 VHL (0.41) CCNE1CDK2VHLALDH1A1GAA
SCHEMBL27048554 0.80 CCNE1 (0.35) CCNE1CDK2HTTCYP19A1
SCHEMBL14262395 0.80 CYP19A1 (0.37) CCNE1CDK2ALDH1A1KDM4EL3MBTL1
SCHEMBL23308741 0.79 CCNE1 (0.38) CCNE1CDK2ALDH1A1GAAMAPT
SCHEMBL16674191 0.79 CYP1A2 (0.41) CCNE1CDK2ALDH1A1HTTCYP19A1
SCHEMBL26225463 0.76 CCNE1 (0.34) CCNE1CDK2ALDH1A1GAAMAPT
SCHEMBL25859567 0.76 VHL (0.41) CCNE1CDK2VHLALDH1A1GAA
SCHEMBL20997046 0.74 PARP14 (0.41) KDM4ELMNA
SCHEMBL27048556 0.74 CYP19A1 (0.46) KMT2ACYP19A1

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-20230159554-A1 COMPOUND WITH ANTICANCER ACTIVITY KYOWA KIRIN CO., LTD. (JP) 2023-05-25 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-20230159554-A1 COMPOUND WITH ANTICANCER ACTIVITY TP53, H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16, RCC2 CCNE1 27/4885CDK2 290/4885VHL 60/4885

“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.