SCHEMBL29633833

SCHEMBL29633833

COc1ccc(CC(C(=O)OC(C)(C)C)N(C)C(=O)OCC2c3ccccc3-c3ccccc32)cc1OC

nearest known ligand 0.40

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
FABP5 Q01469 1/20 0.40
LDHA P00338 1/20 0.40
MTNR1A P48039 1/20 0.39
MTNR1B P49286 1/20 0.39
MMP1 P03956 1/20 0.37
ITGA4 P13612 1/20 0.36
ITGB7 P26010 1/20 0.36
KDM4E B2RXH2 2/20 0.35
ALDH1A1 P00352 1/20 0.35
KMT2A Q03164 1/20 0.35
THRB P10828 1/20 0.35
OPRD1 P41143 1/20 0.35
OPRK1 P41145 1/20 0.35
PTPN1 P18031 1/20 0.34
BCHE P06276 1/20 0.34
ACHE P22303 1/20 0.34
LMNA P02545 1/20 0.34

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
SCHEMBL29633786 0.93 FABP5 (0.38) FABP5LDHAMMP1ITGA4ITGB7
SCHEMBL29633852 0.91 FABP5 (0.39) FABP5MTNR1AMTNR1BKDM4EALDH1A1
SCHEMBL29633713 0.90 PPARA (0.38) FABP5PTPN1
SCHEMBL29633974 0.89 FABP5 (0.36) FABP5ITGA4ITGB7ALDH1A1KMT2A
SCHEMBL29633748 0.89 FABP5 (0.37) FABP5LDHAITGA4ITGB7
SCHEMBL25358230 0.88 LDHA (0.48) FABP5LDHAMMP1KDM4EALDH1A1
SCHEMBL25358236 0.88 LDHA (0.48) FABP5LDHAMMP1KDM4EALDH1A1
SCHEMBL29633843 0.88 CACNA1B (0.36) FABP5MMP1KMT2A
SCHEMBL29633698 0.87 FABP5 (0.39) FABP5ITGA4ITGB7KMT2A
SCHEMBL29633830 0.87 FABP5 (0.44) FABP5ITGA4ITGB7ALDH1A1KMT2A

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 FABP5 608/4885LDHA 901/4885MTNR1A 3642/4885
US-20220144762-A1 METHOD FOR PREPARING AROMATIC AMINO ACID DERIVATIVE DDC, AADAT, TYR FABP5 608/4885LDHA 901/4885MTNR1A 3642/4885
US-12071396-B2 Method for preparing aromatic amino acid derivative DDC, AADAT, TYR FABP5 608/4885LDHA 901/4885MTNR1A 3642/4885

“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.