SCHEMBL30004587

SCHEMBL30004587

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

nearest known ligand 0.67

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ ERAP2 Q6P179 3/20 0.67
▸ ECE1 P42892 10/20 0.64
▸ ACE P12821 2/20 0.60
▸ IL1RN P18510 2/20 0.55
▸ ERAP1 Q9NZ08 2/20 0.55
▸ MMP2 P08253 2/20 0.55
▸ MMP9 P14780 1/20 0.55
▸ MMP8 P22894 1/20 0.55
▸ MMP1 P03956 1/20 0.55

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
SCHEMBL30123123 0.93 ERAP2 (0.76) ERAP2ECE1ACEIL1RNERAP1
SCHEMBL31074338 0.92 ERAP2 (0.67) ERAP2ECE1ACEIL1RNERAP1
SCHEMBL31373854 0.91 ECE1 (0.75) ERAP2ECE1ACE
SCHEMBL30958345 0.89 ERAP2 (0.57) ERAP2ECE1ACE
SCHEMBL31042843 0.89 ERAP2 (0.73) ERAP2ECE1ACEIL1RNERAP1
SCHEMBL31720529 0.88 ERAP2 (0.74) ERAP2ECE1ACEIL1RNERAP1
SCHEMBL30734418 0.88 ERAP2 (0.66) ERAP2ECE1ACEIL1RNERAP1
SCHEMBL30311117 0.88 ECE1 (0.72) ERAP2ECE1ACE
SCHEMBL29883632 0.88 MMP2 (0.67) ERAP2ECE1ACEIL1RNERAP1
SCHEMBL30788008 0.87 ECE1 (0.66) ERAP2ECE1ACEIL1RNERAP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11866518-B2 Bicyclic peptide ligands specific for TSLP BICYCLETX LIMITED (GB) 2024-01-09 — — US disclosed
EP-4132481-A1 BICYCLIC PEPTIDE LIGANDS SPECIFIC FOR TSLP BicycleTX Limited (GB) 2023-02-15 — — EP disclosed
US-20220363718-A1 BICYCLIC PEPTIDE LIGANDS SPECIFIC FOR TSLP BICYCLETX LIMITED (GB) 2022-11-17 — — 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 (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-20220363718-A1 BICYCLIC PEPTIDE LIGANDS SPECIFIC FOR TSLP TSLP, VIP, CCL2 ERAP2 430/4885ECE1 503/4885ACE 1075/4885
US-11866518-B2 Bicyclic peptide ligands specific for TSLP TSLP, VIP, CCL2 ERAP2 430/4885ECE1 503/4885ACE 1075/4885

“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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