SCHEMBL21964068

SCHEMBL21964068

CCOC(=O)CN(C(=O)C(C)(C)C)[C@H]1CCN(C(=O)O)C1

nearest known ligand 0.35

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.35
MAPT P10636 2/20 0.35
HSD11B1 P28845 2/20 0.34
GAA P10253 3/20 0.34
THRB P10828 1/20 0.32
ATM Q13315 1/20 0.32
POLB P06746 1/20 0.32
ALDH1A1 P00352 3/20 0.32
MEN1 O00255 2/20 0.32
KMT2A Q03164 2/20 0.32
TSHR P16473 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32

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
SCHEMBL21964077 0.93 L3MBTL1 (0.42) L3MBTL1MAPTGAAPOLBALDH1A1
SCHEMBL21964207 0.88 L3MBTL1 (0.38) L3MBTL1MAPTGAATHRBATM
SCHEMBL21964180 0.82 L3MBTL1 (0.42) L3MBTL1MAPTPOLBALDH1A1MEN1
SCHEMBL6110479 0.80 L3MBTL1 (0.43) L3MBTL1MAPTGAATHRBATM
SCHEMBL22011478 0.80 ALDH1A1 (0.43) L3MBTL1MAPTHSD11B1ALDH1A1MEN1
SCHEMBL21964069 0.80 POLB (0.36) L3MBTL1MAPTHSD11B1POLBALDH1A1
SCHEMBL21964127 0.80 L3MBTL1 (0.39) L3MBTL1MAPTPOLBALDH1A1MEN1
SCHEMBL28604432 0.79 ALDH1A1 (0.40) L3MBTL1MAPTHSD11B1ALDH1A1MEN1
SCHEMBL28919216 0.78 HPGD (0.43) MAPTALDH1A1MEN1KMT2ASMN1; SMN2
SCHEMBL24220778 0.78 CA12 (0.31)

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220023281-A1 HETEROCYCLIC SPIRO-COMPOUNDS AS AM2 RECEPTOR INHIBITORS THE UNIVERSITY OF SHEFFIELD (GB) 2022-01-27 US disclosed
EP-3880679-A1 HETEROCYCLIC SPIRO-COMPOUNDS AS AM2 RECEPTOR INHIBITORS The University Of Sheffield (GB) 2021-09-22 EP disclosed
CN-113227091-A As AM2Heterocyclic spiro-compounds as receptor inhibitors 谢菲尔德大学 2021-08-06 CN disclosed
WO-2020099882-A1 HETEROCYCLIC SPIRO-COMPOUNDS AS AM2 RECEPTOR INHIBITORS THE UNIVERSITY OF SHEFFIELD (GB) 2020-05-22 WO 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-20220023281-A1 HETEROCYCLIC SPIRO-COMPOUNDS AS AM2 RECEPTOR INHIBITORS MC2R, AGTR2, AGTR1 L3MBTL1 4019/4885MAPT 4581/4885HSD11B1 468/4885

“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.