SCHEMBL29633787

SCHEMBL29633787

CN(C(=O)OCC1c2ccccc2-c2ccccc21)C(Cc1ccc(C2CC2)cc1)C(=O)OC(C)(C)C

nearest known ligand 0.36

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ITGB3 P05106 1/20 0.36
ITGA2B P08514 1/20 0.36
FABP5 Q01469 2/20 0.35
FABP7 O15540 1/20 0.35
KMT2A Q03164 1/20 0.33
PPARG P37231 1/20 0.32
PPARA Q07869 1/20 0.32
PTGIR P43119 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
EPHX2 P34913 1/20 0.32
CASP1 P29466 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
SCHEMBL29633704 0.91 FABP5 (0.34) FABP5FABP7KMT2APTGIREPHX2
SCHEMBL29633887 0.90 FABP7 (0.35) ITGB3ITGA2BFABP5FABP7KMT2A
SCHEMBL29633698 0.89 FABP5 (0.39) ITGB3ITGA2BFABP5FABP7KMT2A
SCHEMBL22454863 0.88 KMT2A (0.35) ITGB3ITGA2BFABP5FABP7KMT2A
SCHEMBL29633720 0.88 PPARG (0.36) ITGB3ITGA2BFABP5FABP7KMT2A
SCHEMBL29633940 0.88 ITGB3 (0.44) ITGB3ITGA2BFABP5FABP7KMT2A
SCHEMBL29633679 0.88 KMT2A (0.35) ITGB3ITGA2BFABP5FABP7KMT2A
SCHEMBL29633971 0.87 ADORA1 (0.39) ITGB3ITGA2BFABP5FABP7KMT2A
SCHEMBL29633980 0.87 FABP5 (0.36) ITGB3ITGA2BFABP5FABP7KMT2A
SCHEMBL29634017 0.87 KMT2A (0.34) FABP5FABP7KMT2APTGIREPHX2

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 ITGB3 4722/4885ITGA2B 4737/4885FABP5 608/4885
US-20220144762-A1 METHOD FOR PREPARING AROMATIC AMINO ACID DERIVATIVE DDC, AADAT, TYR ITGB3 4722/4885ITGA2B 4737/4885FABP5 608/4885
US-12071396-B2 Method for preparing aromatic amino acid derivative DDC, AADAT, TYR ITGB3 4722/4885ITGA2B 4737/4885FABP5 608/4885

“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.