SCHEMBL23833828

SCHEMBL23833828

C=CCCC(CCCCCCC)C(=O)NC(CC(C)C)C(=O)NC(CC(CC=C)C(=O)N(C)C)C(=O)O

nearest known ligand 0.42

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PLA2G2A P14555 2/20 0.42
PLA2G5 P39877 2/20 0.42
MMP3 P08254 8/20 0.40
MMP9 P14780 5/20 0.40
BIRC2 Q13490 2/20 0.39
PDF Q9HBH1 3/20 0.38
MMP1 P03956 1/20 0.35
FAAH O00519 1/20 0.34
PLA2G10 O15496 1/20 0.34
SLC6A5 Q9Y345 1/20 0.33
RRM1 P23921 1/20 0.33
RRM2 P31350 1/20 0.33
RRM2B Q7LG56 1/20 0.33

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
SCHEMBL23833827 1.00 PLA2G2A (0.42) PLA2G2APLA2G5MMP3MMP9BIRC2
SCHEMBL23834054 0.96 PLA2G2A (0.42) PLA2G2APLA2G5MMP3MMP9BIRC2
SCHEMBL23834396 0.96 PLA2G2A (0.42) PLA2G2APLA2G5MMP3MMP9BIRC2
SCHEMBL23834325 0.96 PLA2G2A (0.42) PLA2G2APLA2G5MMP3MMP9BIRC2
SCHEMBL25508499 0.90 BIRC2 (0.43) PLA2G2APLA2G5MMP3MMP9BIRC2
SCHEMBL23833842 0.89 PLA2G2A (0.43) PLA2G2APLA2G5MMP3MMP9BIRC2
SCHEMBL23833843 0.89 PLA2G2A (0.43) PLA2G2APLA2G5MMP3MMP9BIRC2
SCHEMBL23834429 0.87 PLA2G2A (0.39) PLA2G2APLA2G5MMP3MMP9BIRC2
SCHEMBL23834430 0.87 PLA2G2A (0.39) PLA2G2APLA2G5MMP3MMP9BIRC2
SCHEMBL25508478 0.86 BIRC2 (0.43) PLA2G2APLA2G5MMP3MMP9BIRC2

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 2 patents. 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
WO-2021188620-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. (US) 2021-09-23 WO 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 PLA2G2A 3615/4885PLA2G5 1544/4885MMP3 1450/4885

“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.