SCHEMBL29633837

SCHEMBL29633837

CN(C(=O)OCC1c2ccccc2-c2ccccc21)C(Cc1ccc(C(F)(F)F)c(Cl)c1)C(=O)O

nearest known ligand 0.38

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
FABP5 Q01469 3/20 0.38
FABP7 O15540 2/20 0.38
ITGB3 P05106 1/20 0.37
ITGA2B P08514 1/20 0.37
PPARG P37231 2/20 0.36
PPARA Q07869 2/20 0.36
PTPN1 P18031 1/20 0.36
XIAP P98170 1/20 0.33
GPBAR1 Q8TDU6 1/20 0.33
EPHX2 P34913 1/20 0.33
MDM2 Q00987 1/20 0.33
ITGB1 P05556 1/20 0.33
ITGA4 P13612 1/20 0.33
THRA P10827 1/20 0.33
THRB P10828 1/20 0.33
CASP3 P42574 1/20 0.33
KMT2A Q03164 1/20 0.32

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
SCHEMBL29633994 0.91 ITGB3 (0.37) FABP5FABP7ITGB3ITGA2BPPARG
SCHEMBL29633850 0.91 FABP5 (0.37) FABP5FABP7PPARGPPARAPTPN1
SCHEMBL29633668 0.90 FABP7 (0.35) FABP5FABP7PPARGPPARAPTPN1
SCHEMBL29633962 0.90 ITGB3 (0.38) FABP5FABP7ITGB3ITGA2BPPARG
SCHEMBL24633948 0.89 FABP5 (0.42) FABP5FABP7ITGB3ITGA2BPPARG
SCHEMBL30686136 0.89 FABP5 (0.42) FABP5FABP7ITGB3ITGA2BPPARG
SCHEMBL25357124 0.89 FABP5 (0.42) FABP5FABP7ITGB3ITGA2BPPARG
SCHEMBL25360654 0.89 FABP5 (0.42) FABP5FABP7ITGB3ITGA2BPPARG
SCHEMBL31370240 0.87 FABP5 (0.41) FABP5FABP7ITGB3ITGA2BPPARG
SCHEMBL21994734 0.86 FABP5 (0.40) FABP5FABP7ITGB3ITGA2BPPARG

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 608/4885FABP7 1148/4885ITGB3 4722/4885
US-20220144762-A1 METHOD FOR PREPARING AROMATIC AMINO ACID DERIVATIVE DDC, AADAT, TYR FABP5 608/4885FABP7 1148/4885ITGB3 4722/4885
US-12071396-B2 Method for preparing aromatic amino acid derivative DDC, AADAT, TYR FABP5 608/4885FABP7 1148/4885ITGB3 4722/4885

“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.