SCHEMBL23346552

SCHEMBL23346552

CC1(N2C(=O)C=CC2=O)CNC1

nearest known ligand 0.35

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MGLL Q99685 2/20 0.35
GSK3A P49840 1/20 0.35
GSK3B P49841 1/20 0.35
HTR2A P28223 1/20 0.33
HTR2C P28335 1/20 0.33
HTR2B P41595 1/20 0.33
GMNN O75496 1/20 0.31
ALDH1A1 P00352 1/20 0.31
LMNA P02545 1/20 0.31
MAPT P10636 1/20 0.31
THPO P40225 1/20 0.31
BLM P54132 1/20 0.31
PMP22 Q01453 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31

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
SCHEMBL29010932 0.78 MGLL (0.39) MGLLGSK3AGSK3BGMNNALDH1A1
SCHEMBL29010797 0.74 MGLL (0.36) MGLLGSK3AGSK3BGMNNALDH1A1
SCHEMBL29010976 0.74 MGLL (0.36) MGLLGSK3AGSK3BGMNNALDH1A1
SCHEMBL29010970 0.73 HCAR1 (0.36) MGLLGSK3AGSK3BGMNNALDH1A1
SCHEMBL29010796 0.73 HCAR1 (0.36) MGLLGSK3AGSK3BGMNNALDH1A1
SCHEMBL718672 0.73 HCAR1 (0.36) MGLLGSK3AGSK3BGMNNALDH1A1
SCHEMBL23346631 0.72 MGLL (0.37) MGLLGSK3AGSK3BGMNNALDH1A1
SCHEMBL19868966 0.71 GSK3A (0.30) MGLLGSK3AGSK3B
SCHEMBL29307860 0.70 HSD17B10 (0.35) MGLLGMNNALDH1A1LMNAMAPT
SCHEMBL9156754 0.70 GSK3A (0.32) MGLLGSK3AGSK3B

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-20210138077-A1 SELECTIVE DRUG RELEASE FROM INTERNALIZED CONJUGATES OF BIOLOGICALLY ACTIVE COMPOUNDS SEAGEN INC. 2021-05-13 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-20210138077-A1 SELECTIVE DRUG RELEASE FROM INTERNALIZED CONJUGATES OF BIOLOGICALLY ACTIVE COMPOUNDS CTSB, CTSE, CTSZ MGLL 1865/4885GSK3A 4709/4885GSK3B 4346/4885

“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.