SCHEMBL23876808

SCHEMBL23876808

CC(C)N1CCN(C(=O)C(C)(C)C)C[C@@H]1C

nearest known ligand 0.38

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
HRH3 Q9Y5N1 2/20 0.35
CYP2D6 P10635 1/20 0.35
KCNH2 Q12809 1/20 0.35
PDK1 Q15118 2/20 0.32
PDK2 Q15119 2/20 0.32
PDK3 Q15120 2/20 0.32
PDK4 Q16654 2/20 0.32
EGLN1 Q9GZT9 2/20 0.31
SLC6A9 P48067 2/20 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
SCHEMBL23133923 1.00 MEN1 (0.36) MEN1KMT2AHRH3CYP2D6KCNH2
SCHEMBL22248553 0.87 HRH3 (0.33) HRH3CYP2D6KCNH2PDK1PDK2
SCHEMBL21867124 0.80 HRH3 (0.36) MEN1KMT2AHRH3CYP2D6KCNH2
SCHEMBL20528079 0.79 USP2 (0.42) MEN1KMT2AHRH3
SCHEMBL20523460 0.79 USP2 (0.42) MEN1KMT2AHRH3
SCHEMBL13676968 0.79 USP2 (0.42) MEN1KMT2AHRH3
SCHEMBL23312132 0.77 SLC6A9 (0.31) MEN1KMT2AHRH3EGLN1SLC6A9
SCHEMBL21666574 0.77 CHRM1 (0.42) MEN1KMT2APDK1PDK2PDK3
SCHEMBL23569900 0.76 JAK3 (0.38)
SCHEMBL23308415 0.76 JAK3 (0.38)

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-11220490-B2 Ureas having androgen receptor degradation activity and uses thereof ACCUTAR BIOTECHNOLOGY INC. (US) 2022-01-11 US disclosed
US-20210300901-A1 NOVEL UREAS HAVING ANDROGEN RECEPTOR DEGRADATION ACTIVITY AND USES THEREOF ACCUTAR BIOTECHNOLOGY INC. (US) 2021-09-30 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-20210300901-A1 NOVEL UREAS HAVING ANDROGEN RECEPTOR DEGRADATION ACTIVITY AND USES THEREOF AR, UTS2R, ESRRA MEN1 4108/4885KMT2A 3173/4885HRH3 3975/4885
US-11220490-B2 Ureas having androgen receptor degradation activity and uses thereof AR, UTS2R, ESRRA MEN1 3998/4885KMT2A 3141/4885HRH3 3999/4885

“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.