SCHEMBL27175271

SCHEMBL27175271

CC(C)CC[C@H](NC(=O)OC(C)(C)C)C(C)O

nearest known ligand 0.56

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ CA1 P00915 2/20 0.56
▸ CA2 P00918 2/20 0.56
▸ CA7 P43166 2/20 0.56
▸ CYP2D6 P10635 1/20 0.46
▸ CTSK P43235 8/20 0.43
▸ CTSS P25774 3/20 0.42
▸ CTSL P07711 1/20 0.42
▸ CTSB P07858 1/20 0.42
▸ CA4 P22748 1/20 0.39
▸ CA9 Q16790 1/20 0.39
▸ MEN1 O00255 1/20 0.39
▸ GAA P10253 1/20 0.39
▸ KMT2A Q03164 1/20 0.39

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
SCHEMBL20442852 0.86 CA1 (0.56) CA1CA2CA7CYP2D6CTSK
SCHEMBL23016026 0.86 CA1 (0.56) CA1CA2CA7CYP2D6CTSK
SCHEMBL14564667 0.85 CA1 (0.54) CA1CA2CA7CYP2D6CTSK
SCHEMBL10573143 0.84 CA1 (0.62) CA1CA2CA7CYP2D6CTSK
SCHEMBL2987820 0.83 CA1 (0.53) CA1CA2CA7CYP2D6CTSK
SCHEMBL385451 0.83 CA1 (0.53) CA1CA2CA7CYP2D6CTSK
SCHEMBL20825298 0.83 CA1 (0.49) CA1CA2CA7CYP2D6CTSK
SCHEMBL21367441 0.83 CA1 (0.49) CA1CA2CA7CYP2D6CTSK
Hydrochloric Acid SCHEMBL7432944 0.83 CA1 (0.60) CA1CA2CA7CYP2D6CTSK
SCHEMBL17917846 0.82 CA1 (0.59) CA1CA2CA7CYP2D6CTSK

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-20240092739-A1 COMPOUNDS AND METHODS OF USE VENTHERA, INC. 2024-03-21 — — 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-20240092739-A1 COMPOUNDS AND METHODS OF USE AIFM2, SLC40A1, GPX4 CA1 2167/4885CA2 1427/4885CA7 2218/4885

“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.

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