SCHEMBL30104010

SCHEMBL30104010

[2H]C([2H])([2H])O[C@@H]1C[C@@H](CO)N(C(=O)OC(C)(C)C)C1

nearest known ligand 0.44

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
NR1H2 P55055 1/20 0.44
SRC P12931 8/20 0.39
UCHL1 P09936 1/20 0.36
CHRM2 P08172 1/20 0.35
CHRM1 P11229 1/20 0.35
CHRM3 P20309 1/20 0.35
ABCB1 P08183 1/20 0.34
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
CYP1A2 P05177 1/20 0.33
POLB P06746 1/20 0.33
CYP3A4 P08684 1/20 0.33
CYP2C19 P33261 1/20 0.33

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
SCHEMBL21770659 0.91 NR1H2 (0.47) NR1H2SRCUCHL1CHRM2CHRM1
SCHEMBL13163960 0.91 NR1H2 (0.47) NR1H2SRCUCHL1CHRM2CHRM1
SCHEMBL29246157 0.91 NR1H2 (0.47) NR1H2SRCUCHL1CHRM2CHRM1
SCHEMBL1584687 0.91 NR1H2 (0.47) NR1H2SRCUCHL1CHRM2CHRM1
SCHEMBL7918399 0.91 NR1H2 (0.47) NR1H2SRCUCHL1CHRM2CHRM1
SCHEMBL29231967 0.91 NR1H2 (0.47) NR1H2SRCUCHL1CHRM2CHRM1
SCHEMBL1604238 0.91 NR1H2 (0.47) NR1H2SRCUCHL1CHRM2CHRM1
SCHEMBL19181227 0.91 NR1H2 (0.47) NR1H2SRCUCHL1CHRM2CHRM1
SCHEMBL24739166 0.85 NR1H2 (0.47) NR1H2SRCCHRM2CHRM1CHRM3
SCHEMBL18923683 0.84 NR1H2 (0.46) NR1H2SRCCHRM2CHRM1CHRM3

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-20260125396-A1 MACROCYCLIC RIP2-KINASE INHIBITORS ONCODESIGN S.A. (FR) 2026-05-07 US disclosed
EP-4097110-A1 MACROCYCLIC RIP2-KINASE INHIBITORS Oncodesign S.A. (FR) 2022-12-07 EP 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-20260125396-A1 MACROCYCLIC RIP2-KINASE INHIBITORS RIPK1, RIPK2, RIPK4 NR1H2 167/4885SRC 3102/4885UCHL1 3129/4885

“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.