SCHEMBL30799750

SCHEMBL30799750

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

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MMP9 P14780 3/20 0.59
▸ MMP8 P22894 3/20 0.59
▸ MMP2 P08253 2/20 0.59
▸ MMP1 P03956 2/20 0.59
▸ ACE P12821 2/20 0.59
▸ OPRM1 P35372 1/20 0.56
▸ OPRD1 P41143 1/20 0.56
▸ ERAP2 Q6P179 1/20 0.55
▸ ECE1 P42892 7/20 0.55
▸ KDM4E B2RXH2 2/20 0.54
▸ MAPT P10636 2/20 0.54
▸ APAF1 O14727 1/20 0.54
▸ POLB P06746 1/20 0.54
▸ RECQL P46063 1/20 0.54
▸ L3MBTL1 Q9Y468 1/20 0.54
▸ MEN1 O00255 1/20 0.54
▸ LMNA P02545 1/20 0.54
▸ MPO P05164 1/20 0.54
▸ TSHR P16473 1/20 0.54
▸ BLM P54132 1/20 0.54

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
SCHEMBL30830320 0.94 ERAP2 (0.58) MMP9MMP8MMP2MMP1ACE
SCHEMBL30788012 0.93 ERAP2 (0.64) MMP9MMP8MMP2MMP1ACE
SCHEMBL29630749 0.93 ERAP2 (0.61) MMP9MMP8MMP2MMP1ACE
SCHEMBL30051359 0.91 ACE (0.64) MMP9MMP8ACEOPRM1OPRD1
SCHEMBL29828471 0.90 KDM4E (0.59) MMP9MMP8MMP2MMP1ACE
SCHEMBL30050850 0.90 ECE1 (0.65) MMP9MMP8MMP2MMP1ACE
SCHEMBL29749345 0.90 ACE (0.63) MMP9MMP8ACEERAP2ECE1
SCHEMBL30788020 0.89 ECE1 (0.61) MMP9MMP8MMP2MMP1ACE
SCHEMBL10753338 0.89 ACE (0.62) MMP9MMP8ACEOPRM1OPRD1
SCHEMBL31720493 0.88 ERAP2 (0.67) MMP9MMP8MMP2MMP1ACE

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-20240116985-A1 STAPLED PEPTIDES AND METHODS THEREOF PARABILIS MEDICINES, INC. 2024-04-11 — — 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-20240116985-A1 STAPLED PEPTIDES AND METHODS THEREOF CTNNB1, APC, CTNNA1 MMP9 244/4885MMP8 446/4885MMP2 347/4885

“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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