SCHEMBL21964052

SCHEMBL21964052

CC(C)(C)OC(=O)N1CCC[C@H](N(CC(=O)O)C(=O)C(C)(C)C)C1

nearest known ligand 0.46

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.46
ALDH1A1 P00352 1/20 0.46
MAPT P10636 1/20 0.46
KMT2A Q03164 1/20 0.46
HPGD P15428 1/20 0.41
USP30 Q70CQ3 4/20 0.41
HSD11B1 P28845 2/20 0.40
JAK2 O60674 1/20 0.40
JAK1 P23458 1/20 0.40
BACE1 P56817 2/20 0.38
ACKR3 P25106 1/20 0.38
CTSD P07339 1/20 0.38
PRMT5 O14744 1/20 0.38
EPHX1 P07099 1/20 0.37
HSD17B10 Q99714 1/20 0.37
GLS O94925 1/20 0.37
DDB1 Q16531 1/20 0.37
CRBN Q96SW2 1/20 0.37
NR1H2 P55055 1/20 0.36

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
SCHEMBL21964050 1.00 MEN1 (0.46) MEN1ALDH1A1MAPTKMT2AHPGD
SCHEMBL21964124 0.93 USP30 (0.47) MEN1ALDH1A1MAPTKMT2AHPGD
SCHEMBL24220752 0.91 MEN1 (0.45) MEN1ALDH1A1MAPTKMT2AHPGD
SCHEMBL21964206 0.90 HPGD (0.47) MEN1ALDH1A1MAPTKMT2AHPGD
SCHEMBL22011473 0.88 MEN1 (0.45) MEN1ALDH1A1MAPTKMT2AHPGD
SCHEMBL28594993 0.88 MEN1 (0.46) MEN1ALDH1A1MAPTKMT2AHPGD
SCHEMBL24220733 0.88 MEN1 (0.46) MEN1ALDH1A1MAPTKMT2AHPGD
SCHEMBL21964129 0.87 MEN1 (0.42) MEN1ALDH1A1MAPTKMT2AHPGD
SCHEMBL22011478 0.86 ALDH1A1 (0.43) MEN1ALDH1A1MAPTKMT2AHPGD
SCHEMBL24220724 0.83 ALDH1A1 (0.41) MEN1ALDH1A1MAPTKMT2AHPGD

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
WO-2020099882-A1 HETEROCYCLIC SPIRO-COMPOUNDS AS AM2 RECEPTOR INHIBITORS THE UNIVERSITY OF SHEFFIELD (GB) 2020-05-22 WO 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 MEN1 6/4885ALDH1A1 1456/4885MAPT 4581/4885

“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.