SCHEMBL26470386

SCHEMBL26470386

CNS(=O)(=O)N1CCC(C(C)(C)C)CC1

nearest known ligand 0.42

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ACLY P53396 1/20 0.42
CYP2D6 P10635 1/20 0.35
KCNH2 Q12809 1/20 0.35
HRH3 Q9Y5N1 1/20 0.35
DDIT3 P35638 1/20 0.34
EPHX2 P34913 1/20 0.33
MGAT2 Q10469 1/20 0.33
CCNE1 P24864 5/20 0.32
CDK2 P24941 5/20 0.32
CCND1 P24385 4/20 0.32
CDK6 Q00534 4/20 0.32
EPHX1 P07099 1/20 0.31
TP53 P04637 1/20 0.31
ALDH1A1 P00352 1/20 0.31
HSD11B1 P28845 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
SCHEMBL28580229 0.82 CNR1 (0.35) ACLYCCNE1CDK2CCND1CDK6
SCHEMBL14971519 0.77 MEN1 (0.44) ALDH1A1
SCHEMBL1104697 0.77 TP53 (0.46) ACLYCYP2D6KCNH2HRH3TP53
SCHEMBL26470411 0.77 CA1 (0.42) ACLYCYP2D6KCNH2HRH3DDIT3
SCHEMBL12201520 0.75 EPHX2 (0.39) ACLYCYP2D6KCNH2HRH3DDIT3
SCHEMBL22959646 0.75 CYP2D6 (0.37) ACLYCYP2D6KCNH2HRH3DDIT3
SCHEMBL4478067 0.75 KDM4E (0.42) CYP2D6KCNH2HRH3TP53ALDH1A1
SCHEMBL12765367 0.75 MAPK1 (0.40) CCNE1CDK2CCND1CDK6TP53
SCHEMBL2424959 0.75 CCNE1 (0.33) CCNE1CDK2CCND1CDK6TP53
SCHEMBL12765346 0.75

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-20230135215-A1 COMPOUNDS AS CDK2/4/6 INHIBITORS FOCHON BIOSCIENCES, LTD. (CN) 2023-05-04 US disclosed
US-20230135215-A1 COMPOUNDS AS CDK2/4/6 INHIBITORS FOCHON BIOSCIENCES, LTD. (CN) 2023-05-04 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-20230135215-A1 COMPOUNDS AS CDK2/4/6 INHIBITORS CDK2, CDK6, CDK20 ACLY 3600/4885CYP2D6 429/4885KCNH2 4809/4885

“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.