SCHEMBL29633808

SCHEMBL29633808

Cc1cncc(CC(C(=O)OC(C)(C)C)N(C)C(=O)OCC2c3ccccc3-c3ccccc32)c1

nearest known ligand 0.34

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PTGIR P43119 1/20 0.33
EPHX2 P34913 1/20 0.33
CTSB P07858 1/20 0.33
KMT2A Q03164 1/20 0.32
MDM2 Q00987 1/20 0.32
FABP5 Q01469 2/20 0.32
FABP7 O15540 1/20 0.32
MDM4 O15151 1/20 0.32
TP53 P04637 1/20 0.32
CYP11B1 P15538 1/20 0.31
CYP11B2 P19099 1/20 0.31
CASP3 P42574 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
SCHEMBL25657533 1.00 PTGIR (0.33) PTGIREPHX2CTSBKMT2AMDM2
SCHEMBL29633742 0.91 EPHX2 (0.34) PTGIREPHX2KMT2AMDM2FABP5
SCHEMBL29633899 0.90 EPHX2 (0.32) EPHX2KMT2AMDM2FABP5FABP7
SCHEMBL29634049 0.90 ADORA2A (0.34) PTGIREPHX2KMT2AMDM2FABP5
SCHEMBL29633728 0.90 FABP5 (0.34) EPHX2KMT2AMDM2FABP5FABP7
SCHEMBL29633707 0.90 EPHX2 (0.32) EPHX2KMT2AMDM2FABP5FABP7
SCHEMBL25657532 0.89 PTGIR (0.35) PTGIREPHX2KMT2AMDM2FABP5
SCHEMBL29633992 0.89 PTGIR (0.35) PTGIREPHX2KMT2AMDM2FABP5
SCHEMBL25178688 0.89 PTGIR (0.37) PTGIREPHX2CTSBKMT2AMDM2
SCHEMBL22454847 0.89 KMT2A (0.34) EPHX2KMT2AMDM2FABP5FABP7

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 PTGIR 4370/4885EPHX2 2165/4885CTSB 2340/4885
US-20220144762-A1 METHOD FOR PREPARING AROMATIC AMINO ACID DERIVATIVE DDC, AADAT, TYR PTGIR 4370/4885EPHX2 2165/4885CTSB 2340/4885
US-12071396-B2 Method for preparing aromatic amino acid derivative DDC, AADAT, TYR PTGIR 4370/4885EPHX2 2165/4885CTSB 2340/4885

“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.