SCHEMBL24740404

SCHEMBL24740404

CCCC(C)C1CC(C)(C)NC1=O

nearest known ligand 0.32

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.32
ALDH1A1 P00352 1/20 0.32
CYP3A4 P08684 1/20 0.32
GABRB3 P28472 1/20 0.32
OPRD1 P41143 1/20 0.32
GABRA2 P47869 1/20 0.32
GABRB2 P47870 1/20 0.32
LMNA P02545 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
SCHEMBL24029303 0.85 KDM4E (0.31) KDM4EALDH1A1CYP3A4GABRB3OPRD1
SCHEMBL20239773 0.77 PGR (0.39) ALDH1A1LMNA
SCHEMBL25560572 0.77 PGR (0.39) ALDH1A1LMNA
SCHEMBL24029214 0.77 PGR (0.39) ALDH1A1LMNA
SCHEMBL24740337 0.73 HSD11B1 (0.31) KDM4EALDH1A1CYP3A4GABRB3OPRD1
SCHEMBL24029106 0.72 ACE (0.31) ALDH1A1CYP3A4
SCHEMBL26644809 0.69 KDM4E (0.35) KDM4EALDH1A1CYP3A4GABRB3OPRD1
SCHEMBL23836578 0.68 CCR2 (0.39) KDM4EALDH1A1CYP3A4GABRB3OPRD1
SCHEMBL26644807 0.68 KDM4E (0.31) KDM4EALDH1A1CYP3A4GABRB3OPRD1
SCHEMBL24019608 0.67 PSMB5 (0.30)

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-11524940-B1 Inhibitors of cysteine proteases and methods of use thereof Pardes Biosciences, Inc. (US) 2022-12-13 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-11524940-B1 Inhibitors of cysteine proteases and methods of use thereof CTRL, CTSV, CTSL KDM4E 2930/4885ALDH1A1 2252/4885CYP3A4 944/4885

“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.