SCHEMBL29633790

SCHEMBL29633790

CN(OC1CCCCO1)C(=O)c1ccc(CCC(NC(=O)OCC2c3ccccc3-c3ccccc32)C(=O)O)cc1

nearest known ligand 0.44

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
TLR2 O60603 3/20 0.44
MDM2 Q00987 6/20 0.40
MDM4 O15151 2/20 0.40
TP53 P04637 2/20 0.40
FDFT1 P37268 1/20 0.40
TNF P01375 1/20 0.38
CASP3 P42574 1/20 0.38

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
SCHEMBL30278738 0.92 ITGB1 (0.45) TLR2MDM2MDM4TP53FDFT1
SCHEMBL29633818 0.92 ITGB1 (0.45) TLR2MDM2MDM4TP53FDFT1
SCHEMBL22109018 0.92 ITGB1 (0.45) TLR2MDM2MDM4TP53FDFT1
SCHEMBL22109019 0.92 ITGB1 (0.45) TLR2MDM2MDM4TP53FDFT1
SCHEMBL29633687 0.92 TLR2 (0.37) TLR2MDM2MDM4TP53
SCHEMBL22092100 0.88 ITGB1 (0.40) TLR2
SCHEMBL22108753 0.88 ITGB1 (0.40) TLR2
SCHEMBL30278713 0.88 ITGB1 (0.40) TLR2
SCHEMBL30278735 0.88 ITGB1 (0.40) TLR2
SCHEMBL29633853 0.86 MDM4 (0.38) TLR2MDM2MDM4TP53

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-20240376044-A1 METHOD FOR PREPARING AROMATIC AMINO ACID DERIVATIVE CHUGAI PHARMACEUTICAL CO LTD (JP) 2024-11-14 US disclosed
US-12071396-B2 Method for preparing aromatic amino acid derivative CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2024-08-27 US disclosed
US-20220144762-A1 METHOD FOR PREPARING AROMATIC AMINO ACID DERIVATIVE CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2022-05-12 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 (3 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-20240376044-A1 METHOD FOR PREPARING AROMATIC AMINO ACID DERIVATIVE DDC, AADAT, TYR TLR2 3180/4885MDM2 223/4885MDM4 381/4885
US-20220144762-A1 METHOD FOR PREPARING AROMATIC AMINO ACID DERIVATIVE DDC, AADAT, TYR TLR2 3180/4885MDM2 223/4885MDM4 381/4885
US-12071396-B2 Method for preparing aromatic amino acid derivative DDC, AADAT, TYR TLR2 3180/4885MDM2 223/4885MDM4 381/4885

“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.