SCHEMBL29633726

SCHEMBL29633726

COc1c(F)cc(CC(C(=O)OC(C)(C)C)N(C)C(=O)OCC2c3ccccc3-c3ccccc32)cc1F

nearest known ligand 0.35

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
FABP5 Q01469 2/20 0.35
EPHX2 P34913 1/20 0.33
KMT2A Q03164 1/20 0.32
FABP7 O15540 1/20 0.32
ITGA4 P13612 1/20 0.31
ITGB7 P26010 1/20 0.31
MDM4 O15151 1/20 0.31
TP53 P04637 1/20 0.31
MDM2 Q00987 1/20 0.31

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
SCHEMBL29633892 0.91 FABP5 (0.34) FABP5EPHX2KMT2AFABP7ITGA4
SCHEMBL29633786 0.89 FABP5 (0.38) FABP5ITGA4ITGB7
SCHEMBL29633639 0.89 FABP5 (0.39) FABP5EPHX2KMT2AFABP7MDM4
SCHEMBL29633980 0.86 FABP5 (0.36) FABP5KMT2AFABP7
SCHEMBL29633681 0.86 PPARG (0.33) FABP5EPHX2KMT2AFABP7
SCHEMBL22454862 0.86 PPARG (0.33) FABP5EPHX2KMT2AFABP7
SCHEMBL29633950 0.86 PPARG (0.33) FABP5EPHX2KMT2AFABP7
SCHEMBL29633698 0.85 FABP5 (0.39) FABP5KMT2AFABP7ITGA4ITGB7
SCHEMBL29633833 0.85 FABP5 (0.40) FABP5KMT2AITGA4ITGB7
SCHEMBL29633939 0.85 CTSS (0.39) EPHX2KMT2ATP53

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 608/4885EPHX2 2165/4885KMT2A 355/4885
US-20220144762-A1 METHOD FOR PREPARING AROMATIC AMINO ACID DERIVATIVE DDC, AADAT, TYR FABP5 608/4885EPHX2 2165/4885KMT2A 355/4885
US-12071396-B2 Method for preparing aromatic amino acid derivative DDC, AADAT, TYR FABP5 608/4885EPHX2 2165/4885KMT2A 355/4885

“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.