SCHEMBL30003706

SCHEMBL30003706

C#CCCNC(=O)[C@H](CCCCNC(=O)CCC#C)NC(=O)CCC#C

nearest known ligand 0.42

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
GLP1R P43220 8/20 0.42
NMT2 O60551 2/20 0.39
NMT1 P30419 2/20 0.39
SIRT6 Q8N6T7 1/20 0.39
SIRT1 Q96EB6 1/20 0.39
TLR2 O60603 1/20 0.37
NOD1 Q9Y239 2/20 0.37
L3MBTL1 Q9Y468 1/20 0.36
LPAR3 Q9UBY5 3/20 0.36
LPAR1 Q92633 1/20 0.36

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
SCHEMBL30003719 0.86 NOD1 (0.48) GLP1RNOD1
SCHEMBL30003728 0.80 KMT2A (0.50) GLP1RSIRT1NOD1L3MBTL1
SCHEMBL22994980 0.80 NOD1 (0.37) GLP1RNMT2NMT1SIRT6SIRT1
SCHEMBL22805060 0.78 SIRT6 (0.46) GLP1RNMT2NMT1SIRT6SIRT1
SCHEMBL22805061 0.78 SIRT6 (0.46) GLP1RNMT2NMT1SIRT6SIRT1
SCHEMBL23330800 0.75 ALB (0.42) SIRT6SIRT1TLR2NOD1L3MBTL1
SCHEMBL254806 0.75 L3MBTL1 (0.43) L3MBTL1
SCHEMBL18496714 0.75 FOLH1 (0.64)
SCHEMBL18516882 0.75 FOLH1 (0.64)
SCHEMBL18516883 0.75 FOLH1 (0.64)

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 GLP1R 712/4885NMT2 1466/4885NMT1 1618/4885
US-11866518-B2 Bicyclic peptide ligands specific for TSLP TSLP, VIP, CCL2 GLP1R 712/4885NMT2 1466/4885NMT1 1618/4885

“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.