SCHEMBL23680475

SCHEMBL23680475

NC(=O)NCCC[C@H](NC[C@@H](N)Cc1ccccc1)C(=O)Nc1ccc(CO)cc1

nearest known ligand 0.47

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
GGT1 P19440 2/20 0.47
SMN1; SMN2 Q16637 1/20 0.43
MMP2 P08253 4/20 0.43
SIRT5 Q9NXA8 1/20 0.39
KLKB1 P03952 1/20 0.39
PRSS1 P07477 1/20 0.39
PRSS2 P07478 1/20 0.39
PRSS3 P35030 1/20 0.39

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
SCHEMBL23286133 0.89 SMN1; SMN2 (0.46) SMN1; SMN2SIRT5
SCHEMBL16450329 0.89 SMN1; SMN2 (0.46) SMN1; SMN2SIRT5
SCHEMBL29071221 0.82 SPHK1 (0.37) MMP2
SCHEMBL22264483 0.82 SIRT1 (0.41) SMN1; SMN2MMP2SIRT5
SCHEMBL17803625 0.82 SIRT1 (0.41) SMN1; SMN2MMP2SIRT5
SCHEMBL23680474 0.81 ATM (0.48) SIRT5
SCHEMBL25932816 0.80 SIRT5 (0.62) SIRT5PRSS1PRSS2PRSS3
SCHEMBL30527290 0.80 SIRT5 (0.62) SIRT5PRSS1PRSS2PRSS3
SCHEMBL24475446 0.79 SPHK1 (0.49) MMP2KLKB1PRSS1
SCHEMBL27431579 0.79 SPHK1 (0.49) MMP2KLKB1PRSS1

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-20210230218-A1 OLIGOPEPTIDE LINKER INTERMEDIATE AND PREPARATION METHOD THEREOF MABPLEX INTERNATIONAL, LTD. (CN) 2021-07-29 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-20210230218-A1 OLIGOPEPTIDE LINKER INTERMEDIATE AND PREPARATION METHOD THEREOF VIP, DNPEP, PREP GGT1 2409/4885SMN1; SMN2 1997/4885MMP2 1070/4885

“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.