SCHEMBL26421730

SCHEMBL26421730

CC(C)(C)N[C@@H](CC(=O)O)C(=O)N[C@@H](CCc1c[nH]c2ccccc12)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)C(C)(C)C

nearest known ligand 0.47

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ MMP2 P08253 7/20 0.47
▸ MMP8 P22894 6/20 0.47
▸ MMP9 P14780 5/20 0.47
▸ MMP1 P03956 2/20 0.47
▸ CCKBR P32239 9/20 0.44
▸ CTSL P07711 1/20 0.43
▸ CTSS P25774 1/20 0.43
▸ CTSK P43235 1/20 0.43
▸ ACE P12821 1/20 0.42
▸ TACR3 P29371 1/20 0.42
▸ ECE1 P42892 1/20 0.42

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
SCHEMBL26421722 0.88 MMP2 (0.54) MMP2MMP8MMP9MMP1CCKBR
SCHEMBL26421800 0.85 NPY1R (0.46) MMP2MMP8MMP9CCKBR
SCHEMBL26421849 0.80 KISS1R (0.47) MMP2MMP8MMP9CCKBR
SCHEMBL26421774 0.78 EDNRA (0.55) MMP2MMP8MMP9MMP1CCKBR
SCHEMBL24668049 0.77 MMP2 (0.53) MMP2MMP8MMP9MMP1CCKBR
SCHEMBL30096974 0.77 KDM4E (0.52) MMP2MMP8MMP9MMP1ACE
SCHEMBL29884162 0.77 GHSR (0.54) —
SCHEMBL30450384 0.77 GHSR (0.54) —
SCHEMBL30643024 0.76 CTSL (0.65) CCKBRCTSLCTSSCTSKACE
SCHEMBL30059119 0.76 GHSR (0.53) —

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-20230128688-A1 DIRECTED CONJUGATION TECHNOLOGIES KLEO PHARMACEUTICALS, INC. 2023-04-27 — — 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-20230128688-A1 DIRECTED CONJUGATION TECHNOLOGIES CD2BP2, CD2, CD47 MMP2 1511/4885MMP8 1244/4885MMP9 2922/4885

“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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