SCHEMBL29633772

SCHEMBL29633772

CN(C(=O)OCC1c2ccccc2-c2ccccc21)C(CCc1cncc(Br)c1)C(=O)O

nearest known ligand 0.36

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MDM2 Q00987 2/20 0.36
HCRTR1 O43613 1/20 0.35
HCRTR2 O43614 1/20 0.35
EPHX2 P34913 1/20 0.35
FABP5 Q01469 3/20 0.34
FABP7 O15540 2/20 0.34
KMT2A Q03164 3/20 0.34
MDM4 O15151 1/20 0.33
TP53 P04637 1/20 0.33
TSHR P16473 1/20 0.33
MAPK1 P28482 1/20 0.33
CASP3 P42574 1/20 0.33
ITGA4 P13612 1/20 0.33
ITGB7 P26010 1/20 0.33

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
SCHEMBL29633930 0.91 FABP5 (0.35) MDM2EPHX2FABP5FABP7KMT2A
SCHEMBL29633954 0.90 MDM2 (0.36) MDM2EPHX2FABP5FABP7KMT2A
SCHEMBL29634027 0.89 HCRTR1 (0.34) MDM2HCRTR1HCRTR2EPHX2FABP5
SCHEMBL29633650 0.89 FABP5 (0.37) MDM2EPHX2FABP5FABP7KMT2A
SCHEMBL29633868 0.89 MDM2 (0.36) MDM2EPHX2FABP5FABP7KMT2A
SCHEMBL29633729 0.89 MDM4 (0.36) MDM2EPHX2FABP5FABP7KMT2A
SCHEMBL29633869 0.88 MDM2 (0.38) MDM2EPHX2FABP5FABP7MDM4
SCHEMBL29633884 0.88 FABP5 (0.37) MDM2EPHX2FABP5FABP7KMT2A
SCHEMBL25182955 0.86 CHRNA7 (0.39) FABP5FABP7
SCHEMBL25182953 0.86 CHRNA7 (0.39) FABP5FABP7

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 MDM2 223/4885HCRTR1 4550/4885HCRTR2 4381/4885
US-20220144762-A1 METHOD FOR PREPARING AROMATIC AMINO ACID DERIVATIVE DDC, AADAT, TYR MDM2 223/4885HCRTR1 4550/4885HCRTR2 4381/4885
US-12071396-B2 Method for preparing aromatic amino acid derivative DDC, AADAT, TYR MDM2 223/4885HCRTR1 4550/4885HCRTR2 4381/4885

“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.