SCHEMBL30004437

SCHEMBL30004437

O=C(N[C@@H](CS)C(=O)NCCc1ccccc1)OCC1c2ccccc2-c2ccccc21

nearest known ligand 0.63

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.48
MDM4 O15151 1/20 0.47
TP53 P04637 1/20 0.47
CASP3 P42574 2/20 0.45
FDFT1 P37268 2/20 0.44
NMBR P28336 1/20 0.44
CA5A P35218 1/20 0.44

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
SCHEMBL5963320 1.00 KMT2A (0.48) KMT2AMDM4TP53CASP3FDFT1
SCHEMBL5963770 0.93 KMT2A (0.47) KMT2AMDM4TP53CASP3FDFT1
SCHEMBL2245010 0.88 KMT2A (0.54) KMT2AMDM4TP53CASP3
SCHEMBL14787476 0.86 KMT2A (0.51) KMT2AMDM4TP53CASP3FDFT1
SCHEMBL30554761 0.86 KMT2A (0.51) KMT2AMDM4TP53CASP3FDFT1
SCHEMBL17446719 0.85 PTPN1 (0.48) KMT2AMDM4TP53
SCHEMBL14787175 0.84 MDM4 (0.48) KMT2AMDM4TP53CASP3FDFT1
SCHEMBL26980990 0.84 TLR2 (0.54) KMT2A
SCHEMBL26980963 0.84 TLR2 (0.54) KMT2A
SCHEMBL14787531 0.83 MDM4 (0.52) MDM4TP53CASP3FDFT1

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 KMT2A 4455/4885MDM4 2209/4885TP53 300/4885
US-11866518-B2 Bicyclic peptide ligands specific for TSLP TSLP, VIP, CCL2 KMT2A 4455/4885MDM4 2209/4885TP53 300/4885

“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.