SCHEMBL22959646

SCHEMBL22959646

CC(C)(C)C1CCN(S(=O)(=O)C(C)(C)C)CC1

nearest known ligand 0.37

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CYP2D6 P10635 1/20 0.37
KCNH2 Q12809 1/20 0.37
HRH3 Q9Y5N1 1/20 0.37
ACLY P53396 1/20 0.35
DDIT3 P35638 1/20 0.33
ALDH1A1 P00352 1/20 0.32
EPHX2 P34913 1/20 0.32
HSD11B1 P28845 1/20 0.32
MGAT2 Q10469 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
SCHEMBL8239122 0.88 CYP2D6 (0.32) CYP2D6KCNH2HRH3ACLYALDH1A1
SCHEMBL18531901 0.84 EPHX1 (0.36) ALDH1A1
SCHEMBL18711984 0.83 HSD11B1 (0.36) ALDH1A1HSD11B1
SCHEMBL12385784 0.83 ACLY (0.36) CYP2D6KCNH2HRH3ACLYDDIT3
SCHEMBL12201520 0.83 EPHX2 (0.39) CYP2D6KCNH2HRH3ACLYDDIT3
SCHEMBL15978962 0.80 MEN1 (0.44) ALDH1A1HSD11B1
SCHEMBL26470411 0.80 CA1 (0.42) CYP2D6KCNH2HRH3ACLYDDIT3
SCHEMBL1104697 0.80 TP53 (0.46) CYP2D6KCNH2HRH3ACLYALDH1A1
SCHEMBL12384633 0.79 EPHX2 (0.44) CYP2D6KCNH2HRH3ACLYDDIT3
SCHEMBL12251557 0.78 HSD11B1 (0.44) ALDH1A1HSD11B1

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-11771697-B2 Small molecule degraders of polybromo-1 (PBRM1) DANA-FARBER CANCER INSTITUTE, INC. (US) 2023-10-03 US disclosed
US-20210038599-A1 SMALL MOLECULE DEGRADERS OF POLYBROMO-1 (PBRM1) DANA-FARBER CANCER INSTITUTE, INC. (US) 2021-02-11 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-11771697-B2 Small molecule degraders of polybromo-1 (PBRM1) PBRM1, SMARCC1, SMARCC2 CYP2D6 4549/4885KCNH2 4476/4885HRH3 1124/4885
US-20210038599-A1 SMALL MOLECULE DEGRADERS OF POLYBROMO-1 (PBRM1) PBRM1, SMARCC1, SMARCC2 CYP2D6 4549/4885KCNH2 4476/4885HRH3 1124/4885

“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.