SCHEMBL29615970

SCHEMBL29615970

N[C@@H](CC(=O)O)C(=O)N[C@@H](CC1CCCCC1)C(=O)N[C@@H](Cc1ccccc1)C(=O)O

nearest known ligand 0.61

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 1/20 0.61
MME P08473 3/20 0.60
ACE P12821 3/20 0.60
CPA1 P15085 3/20 0.60
ACE2 Q9BYF1 3/20 0.60
MMP2 P08253 8/20 0.55
MMP1 P03956 8/20 0.55
MMP3 P08254 6/20 0.55
OPRM1 P35372 1/20 0.52
OPRD1 P41143 1/20 0.52
FCER2 P06734 2/20 0.52
KLKB1 P03952 1/20 0.50
BACE1 P56817 2/20 0.49
F2R P25116 1/20 0.48

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
SCHEMBL29690852 0.94 LTA4H (0.57) LTA4HMMEACECPA1ACE2
SCHEMBL30982345 0.88 MME (0.67) LTA4HMMEACECPA1ACE2
SCHEMBL30799925 0.88 LTA4H (0.56) LTA4HMMEACECPA1ACE2
SCHEMBL31206426 0.86 MME (0.58) MMEACECPA1ACE2
SCHEMBL29525004 0.86 MME (0.61) MMEACECPA1ACE2
SCHEMBL11548564 0.86 MME (0.61) MMEACECPA1ACE2
SCHEMBL30494635 0.86 MME (0.61) MMEACECPA1ACE2
SCHEMBL135366 0.86 MME (0.61) MMEACECPA1ACE2
SCHEMBL8761646 0.86 MME (0.61) MMEACECPA1ACE2
SCHEMBL668395 0.86 MME (0.61) MMEACECPA1ACE2

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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230022032-A1 uPAR-TARGETED PHOTOTHERMAL OPTICAL PROBES FOR PHOTOTHERMAL THERAPY RIGSHOSPITALET (DK) 2023-01-26 US claimed
EP-4081256-A1 UPAR-TARGETED PHOTOTHERMAL OPTICAL PROBES FOR PHOTOTHERMAL THERAPY Rigshospitalet (DK) 2022-11-02 EP claimed
EP-3999094-B1 A UROKINASE PLASMINOGEN ACTIVATOR RECEPTOR-TARGETING PEPTIDE RIGSHOSPITALET (DK) 2026-02-25 EP disclosed
US-20230022032-A1 uPAR-TARGETED PHOTOTHERMAL OPTICAL PROBES FOR PHOTOTHERMAL THERAPY RIGSHOSPITALET (DK) 2023-01-26 US disclosed
US-20220401585-A1 A UROKINASE PLASMINOGEN ACTIVATOR RECEPTOR-TARGETING PEPTIDE RIGSHOSPITALET (DK) 2022-12-22 US disclosed
EP-4081256-A1 UPAR-TARGETED PHOTOTHERMAL OPTICAL PROBES FOR PHOTOTHERMAL THERAPY Rigshospitalet (DK) 2022-11-02 EP disclosed
EP-3999094-A1 A UROKINASE PLASMINOGEN ACTIVATOR RECEPTOR-TARGETING PEPTIDE Rigshospitalet (DK) 2022-05-25 EP 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 (2 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-20230022032-A1 uPAR-TARGETED PHOTOTHERMAL OPTICAL PROBES FOR PHOTOTHERMAL THERAPY PLAUR, PLAU, PLG LTA4H 264/4885MME 218/4885ACE 1996/4885
US-20220401585-A1 A UROKINASE PLASMINOGEN ACTIVATOR RECEPTOR-TARGETING PEPTIDE PLAUR, PLAU, PLG LTA4H 1346/4885MME 214/4885ACE 742/4885

“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.