SCHEMBL23913175

SCHEMBL23913175

CC(C)(C)CCOCCOC(=O)NC(C)(C)C

nearest known ligand 0.38

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ACHE P22303 1/20 0.32
ALDH1A1 P00352 3/20 0.31
TSHR P16473 3/20 0.31
TP53 P04637 2/20 0.31
HIF1A Q16665 2/20 0.31
HSD17B10 Q99714 1/20 0.31
HRH3 Q9Y5N1 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
SCHEMBL13154766 0.88 CHRM2 (0.32) ACHEALDH1A1TSHR
SCHEMBL28514197 0.83 MEN1 (0.42) ACHEALDH1A1TSHRTP53HIF1A
SCHEMBL29308970 0.83 ABCB11 (0.36) ACHEALDH1A1TSHRTP53HIF1A
SCHEMBL27880456 0.83 ABCB11 (0.36) ACHEALDH1A1TSHRTP53HIF1A
SCHEMBL1065814 0.83 MEN1 (0.42) ACHEALDH1A1TSHRTP53HIF1A
SCHEMBL28512896 0.83 MEN1 (0.42) ACHEALDH1A1TSHRTP53HIF1A
SCHEMBL29104752 0.81 ACHE (0.32) ACHEALDH1A1TSHRTP53HIF1A
SCHEMBL28656034 0.81 ACHE (0.32) ACHEALDH1A1TSHRTP53HIF1A
SCHEMBL25345009 0.81 ACHE (0.32) ACHEALDH1A1TSHRTP53HIF1A
SCHEMBL31425438 0.81 ACHE (0.32) ACHEALDH1A1TSHRTP53HIF1A

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-20220372042-A1 CONDENSED HETEROCYCLES AS BCL-2 INHIBITORS NEWAVE PHARMACEUTICAL INC. 2022-11-24 US disclosed
US-20210315904-A1 BCL-2 INHIBITORS NEWAVE PHARMACEUTICAL INC. 2021-10-14 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-20210315904-A1 BCL-2 INHIBITORS BCL2L10, BCL2, BCL2L11 ACHE 2065/4885ALDH1A1 3743/4885TSHR 3378/4885
US-20220372042-A1 CONDENSED HETEROCYCLES AS BCL-2 INHIBITORS BCL2L11, BCL2L10, BCL2 ACHE 1789/4885ALDH1A1 3666/4885TSHR 3684/4885

“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.