SCHEMBL26097572

SCHEMBL26097572

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

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BTK Q06187 1/20 0.55
CTSK P43235 2/20 0.45
CA1 P00915 1/20 0.41
CA2 P00918 1/20 0.41
HSD11B1 P28845 4/20 0.41
CYP2C9 P11712 1/20 0.41
KMT2A Q03164 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
MMP2 P08253 1/20 0.40
ANPEP P15144 1/20 0.40
KDM1A O60341 1/20 0.40
MAOB P27338 1/20 0.40
NFKB1 P19838 1/20 0.39
NFKB2 Q00653 1/20 0.39
RELA Q04206 1/20 0.39
GAA P10253 1/20 0.38
EPHX2 P34913 1/20 0.36
AGTR2 P50052 1/20 0.36
DRD2 P14416 1/20 0.36
JAK2 O60674 1/20 0.35

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
SCHEMBL21273886 1.00 BTK (0.55) BTKCTSKCA1CA2HSD11B1
SCHEMBL28905732 1.00 BTK (0.55) BTKCTSKCA1CA2HSD11B1
SCHEMBL7728661 0.90 BTK (0.54) BTKCTSKCA1CA2HSD11B1
SCHEMBL7736016 0.90 BTK (0.54) BTKCTSKCA1CA2HSD11B1
SCHEMBL15297652 0.90 BTK (0.54) BTKCTSKCA1CA2HSD11B1
SCHEMBL25235410 0.90 BTK (0.54) BTKCTSKCA1CA2HSD11B1
SCHEMBL7722234 0.90 BTK (0.54) BTKCTSKCA1CA2HSD11B1
SCHEMBL7729066 0.90 BTK (0.54) BTKCTSKCA1CA2HSD11B1
SCHEMBL3865492 0.89 BTK (0.52) BTKCTSKCA1CA2HSD11B1
SCHEMBL22506037 0.89 BTK (0.49) BTKCTSKCA1CA2HSD11B1

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-20230139502-A1 AZA-HETEROCYCLYL CARBOXAMIDE AND RELATED COMPOUNDS AND THEIR USE IN TREATING MEDICAL CONDITIONS X-BIOTIX THERAPEUTICS, INC. 2023-05-04 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-20230139502-A1 AZA-HETEROCYCLYL CARBOXAMIDE AND RELATED COMPOUNDS AND THEIR USE IN TREATING MEDICAL CONDITIONS AADAC, AZI2, CBX7 BTK 911/4885CTSK 982/4885CA1 3543/4885

“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.