SCHEMBL25514934

SCHEMBL25514934

COC(=O)[C@@](I)(CCC(=O)O)NC(=O)OC(C)(C)C

nearest known ligand 0.38

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
DGAT1 O75907 1/20 0.38
NAALAD2 Q9Y3Q0 1/20 0.38
MEN1 O00255 1/20 0.33
GAA P10253 1/20 0.33
KMT2A Q03164 1/20 0.33
CA12 O43570 2/20 0.33
CA14 Q9ULX7 2/20 0.33
CA1 P00915 2/20 0.33
CA7 P43166 2/20 0.33
CA2 P00918 2/20 0.33
TDP1 Q9NUW8 1/20 0.32
PTPRB P23467 1/20 0.32
CTSK P43235 4/20 0.31
MAPT P10636 1/20 0.31
TSHR P16473 1/20 0.31
AKT1 P31749 1/20 0.31
CTSS P25774 2/20 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
SCHEMBL31586221 0.80 DGAT1 (0.42) DGAT1MEN1GAAKMT2ACA12
SCHEMBL1411640 0.80 DGAT1 (0.42) DGAT1MEN1GAAKMT2ACA12
SCHEMBL25513877 0.79 DGAT1 (0.39) DGAT1NAALAD2MEN1GAAKMT2A
SCHEMBL25515595 0.79 DGAT1 (0.39) DGAT1NAALAD2MEN1GAAKMT2A
SCHEMBL23849146 0.78 DGAT1 (0.38) DGAT1NAALAD2MEN1GAAKMT2A
SCHEMBL31239045 0.78 DGAT1 (0.42) DGAT1NAALAD2MEN1GAAKMT2A
SCHEMBL8971824 0.73 NAALAD2 (0.65) NAALAD2MEN1GAAKMT2ACA12
SCHEMBL3031112 0.73 NAALAD2 (0.65) NAALAD2MEN1GAAKMT2ACA12
SCHEMBL1486212 0.72 NAALAD2 (0.44) NAALAD2MEN1GAAKMT2ACA12
SCHEMBL5031613 0.72 NAALAD2 (0.44) NAALAD2MEN1GAAKMT2ACA12

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-20230151034-A1 PEPTIDOMIMETIC N5-METHYL-N2-(NONANOYL-L-LEUCYL)-L-GLUTAMINATE DERIVATIVES, TRIAZASPIRO[4.14]NONADECANE DERIVATIVES AND SIMILAR COMPOUNDS AS INHIBITORS OF NOROVIRUS AND CORONAVIRUS REPLICATION COCRYSTAL PHARMA, INC. 2023-05-18 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-20230151034-A1 PEPTIDOMIMETIC N5-METHYL-N2-(NONANOYL-L-LEUCYL)-L-GLUTAMINATE DERIVATIVES, TRIAZASPIRO[4.14]NONADECANE DERIVATIVES AND SIMILAR COMPOUNDS AS INHIBITORS OF NOROVIRUS AND CORONAVIRUS REPLICATION ASNS, GLUL, GNMT DGAT1 1691/4885NAALAD2 33/4885MEN1 3555/4885

“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.