SCHEMBL30579727

SCHEMBL30579727

CN(C(=O)OC(C)(C)C)C1CC(C(=O)OC(C)(C)C)C1

nearest known ligand 0.42

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 1/20 0.42
ASGR1 P07306 1/20 0.35
HRH3 Q9Y5N1 1/20 0.35
NFKB1 P19838 1/20 0.33
NFKB2 Q00653 1/20 0.33
RELA Q04206 1/20 0.33
MAPK1 P28482 1/20 0.32
BTK Q06187 1/20 0.31
CHRM2 P08172 1/20 0.31
CHRM1 P11229 1/20 0.31
CHRM3 P20309 1/20 0.31
KDM4D Q6B0I6 1/20 0.31
BUB1 O43683 1/20 0.31
PIK3R1 P27986 1/20 0.31
PIK3CA P42336 1/20 0.31
MGLL Q99685 1/20 0.30

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
SCHEMBL18198414 0.90 HSD11B1 (0.40) HSD11B1ASGR1NFKB1NFKB2RELA
SCHEMBL24207518 0.90 HSD11B1 (0.40) HSD11B1ASGR1NFKB1NFKB2RELA
SCHEMBL25250119 0.86 HSD11B1 (0.42) HSD11B1ASGR1NFKB1NFKB2RELA
SCHEMBL25294971 0.86 HSD11B1 (0.42) HSD11B1ASGR1NFKB1NFKB2RELA
SCHEMBL24588156 0.84 HSD11B1 (0.41) HSD11B1ASGR1NFKB1NFKB2RELA
SCHEMBL13567986 0.81 HSD11B1 (0.44) HSD11B1ASGR1NFKB1NFKB2RELA
SCHEMBL16081763 0.81 HSD11B1 (0.44) HSD11B1ASGR1NFKB1NFKB2RELA
SCHEMBL31236410 0.81 HSD11B1 (0.44) HSD11B1ASGR1NFKB1NFKB2RELA
SCHEMBL22822421 0.81 HSD11B1 (0.44) HSD11B1ASGR1NFKB1NFKB2RELA
SCHEMBL24439134 0.81 HSD11B1 (0.44) HSD11B1ASGR1NFKB1NFKB2RELA

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-20230265116-A1 DEGRADATION OF (EGFR) BY CONJUGATION OF EGFR INHIBITORS WITH E3 LIGASE LIGAND AND METHODS OF USE BEONE MEDICINES I GMBH (CH) 2023-08-24 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-20230265116-A1 DEGRADATION OF (EGFR) BY CONJUGATION OF EGFR INHIBITORS WITH E3 LIGASE LIGAND AND METHODS OF USE EGFR, CBL, ERBB2 HSD11B1 4449/4885ASGR1 787/4885HRH3 3390/4885

“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.