SCHEMBL29323047

SCHEMBL29323047

COCCC(=O)NCCCC[C@H](NC(=O)OCC1c2ccccc2-c2ccccc21)C(=O)ON1C(=O)CCC1=O

nearest known ligand 0.52

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ TLR2 O60603 5/20 0.46
▸ KMT2A Q03164 1/20 0.44
▸ MDM2 Q00987 2/20 0.41
▸ TLR1 Q15399 1/20 0.41

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
SCHEMBL18171061 0.95 TLR2 (0.46) TLR2KMT2AMDM2TLR1
SCHEMBL31259028 0.95 TLR2 (0.46) TLR2KMT2AMDM2TLR1
SCHEMBL18171062 0.95 TLR2 (0.46) TLR2KMT2AMDM2TLR1
SCHEMBL16925663 0.89 KMT2A (0.53) TLR2KMT2AMDM2TLR1
SCHEMBL25728451 0.87 MDM2 (0.44) TLR2KMT2AMDM2TLR1
SCHEMBL14770862 0.86 TLR2 (0.44) TLR2KMT2AMDM2
SCHEMBL31010133 0.86 KMT2A (0.52) TLR2KMT2AMDM2TLR1
SCHEMBL20435349 0.86 KMT2A (0.52) TLR2KMT2AMDM2TLR1
SCHEMBL31493934 0.85 TLR2 (0.51) TLR2KMT2AMDM2TLR1
SCHEMBL5312217 0.85 TLR2 (0.51) TLR2KMT2AMDM2TLR1

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-20240226313-A1 CEACAM5 ANTIBODY-DRUG CONJUGATES AND METHODS OF USE THEREOF SEAGEN INC. 2024-07-11 — — 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-20240226313-A1 CEACAM5 ANTIBODY-DRUG CONJUGATES AND METHODS OF USE THEREOF EPCAM, TOP2A, SPAG5 TLR2 3918/4885KMT2A 1496/4885MDM2 4369/4885

“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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