SCHEMBL24420993

SCHEMBL24420993

CCC(=O)C(C)C[C@@H](CC(C)C)NC(C)C

nearest known ligand 0.33

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ PSMB5 P28074 1/20 0.33
▸ MEN1 O00255 1/20 0.32
▸ ALDH1A1 P00352 1/20 0.32
▸ LMNA P02545 1/20 0.32
▸ KMT2A Q03164 1/20 0.32
▸ PLA2G10 O15496 2/20 0.31
▸ KISS1R Q969F8 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
SCHEMBL18882586 0.85 LMNA (0.30) LMNA
SCHEMBL12570564 0.79 RNPEP (0.39) PSMB5ALDH1A1
SCHEMBL18880055 0.76 CPB2 (0.34) —
SCHEMBL13995992 0.76 TDP1 (0.44) MEN1ALDH1A1LMNAKMT2A
SCHEMBL20445378 0.74 ALDH1A1 (0.42) PSMB5MEN1ALDH1A1LMNAKMT2A
SCHEMBL24421009 0.74 ALDH1A1 (0.42) PSMB5MEN1ALDH1A1LMNAKMT2A
SCHEMBL24420991 0.74 ALDH1A1 (0.42) PSMB5MEN1ALDH1A1LMNAKMT2A
SCHEMBL11128512 0.73 TDP1 (0.37) ALDH1A1
SCHEMBL15592753 0.69 CACNA2D1 (0.45) MEN1ALDH1A1LMNAKMT2APLA2G10
SCHEMBL13851589 0.69 CACNA2D1 (0.45) MEN1ALDH1A1LMNAKMT2APLA2G10

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-20220143038-A1 LIPID PRODRUGS OF MYCOPHENOLIC ACID AND USES THEREOF PURETECH LYT, INC. (US) 2022-05-12 — — 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-20220143038-A1 LIPID PRODRUGS OF MYCOPHENOLIC ACID AND USES THEREOF MALT1, CYP2B6, LIPA PSMB5 2452/4885MEN1 1358/4885ALDH1A1 959/4885

“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.

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