SCHEMBL23627443

SCHEMBL23627443

C[C@H](NC(=O)OCC1c2ccccc2-c2ccccc21)C(=O)N[C@@H](CNC(=O)OCC1c2ccccc2-c2ccccc21)C(N)=O

nearest known ligand 0.60

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ PTPN1 P18031 4/20 0.47
▸ KMT2A Q03164 2/20 0.46
▸ TLR2 O60603 2/20 0.45
▸ CASP3 P42574 1/20 0.45
▸ PIN1 Q13526 1/20 0.45

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
SCHEMBL17553455 0.85 TLR2 (0.55) PTPN1KMT2ATLR2CASP3
SCHEMBL21187795 0.84 KMT2A (0.56) PTPN1KMT2ACASP3PIN1
SCHEMBL31326505 0.84 KMT2A (0.56) PTPN1KMT2ACASP3PIN1
SCHEMBL12966414 0.84 KMT2A (0.56) PTPN1KMT2ACASP3PIN1
SCHEMBL29398874 0.84 KMT2A (0.56) PTPN1KMT2ACASP3PIN1
SCHEMBL38660483 0.84 KMT2A (0.56) PTPN1KMT2ACASP3PIN1
SCHEMBL16257642 0.83 KMT2A (0.52) KMT2ATLR2CASP3
SCHEMBL14326310 0.83 CASP3 (0.50) KMT2ACASP3PIN1
SCHEMBL16000769 0.83 CASP3 (0.50) KMT2ACASP3PIN1
SCHEMBL24579257 0.83 CASP3 (0.50) KMT2ACASP3PIN1

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-20210205463-A1 STABILITY-MODULATING LINKERS FOR USE WITH ANTIBODY DRUG CONJUGATES PFIZER INC. (US) 2021-07-08 — — 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-20210205463-A1 STABILITY-MODULATING LINKERS FOR USE WITH ANTIBODY DRUG CONJUGATES FCGR2A, FCGRT, FCGR1A PTPN1 1318/4885KMT2A 1026/4885TLR2 3267/4885

“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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