SCHEMBL29633992

SCHEMBL29633992

COc1cncc(CC(C(=O)OC(C)(C)C)N(C)C(=O)OCC2c3ccccc3-c3ccccc32)c1

nearest known ligand 0.35

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PTGIR P43119 1/20 0.35
CYP11B1 P15538 1/20 0.34
FABP5 Q01469 1/20 0.34
MDM2 Q00987 2/20 0.33
MDM4 O15151 1/20 0.33
TP53 P04637 1/20 0.33
EPHX2 P34913 1/20 0.32
KMT2A Q03164 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
SCHEMBL25657532 1.00 PTGIR (0.35) PTGIRCYP11B1FABP5MDM2MDM4
SCHEMBL29633770 0.91 PTGIR (0.34) PTGIRCYP11B1FABP5MDM2MDM4
SCHEMBL25657533 0.89 PTGIR (0.33) PTGIRCYP11B1FABP5MDM2MDM4
SCHEMBL29633808 0.89 PTGIR (0.33) PTGIRCYP11B1FABP5MDM2MDM4
SCHEMBL25177525 0.89 PTGIR (0.39) PTGIRCYP11B1FABP5MDM2MDM4
SCHEMBL29634050 0.89 PTGIR (0.39) PTGIRCYP11B1FABP5MDM2MDM4
SCHEMBL25179555 0.89 PTGIR (0.39) PTGIRCYP11B1FABP5MDM2MDM4
SCHEMBL29855056 0.89 PTGIR (0.39) PTGIRCYP11B1FABP5MDM2MDM4
SCHEMBL29634049 0.89 ADORA2A (0.34) PTGIRFABP5MDM2MDM4TP53
SCHEMBL29633728 0.89 FABP5 (0.34) FABP5MDM2MDM4TP53EPHX2

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 4370/4885CYP11B1 1294/4885FABP5 608/4885
US-20220144762-A1 METHOD FOR PREPARING AROMATIC AMINO ACID DERIVATIVE DDC, AADAT, TYR PTGIR 4370/4885CYP11B1 1294/4885FABP5 608/4885
US-12071396-B2 Method for preparing aromatic amino acid derivative DDC, AADAT, TYR PTGIR 4370/4885CYP11B1 1294/4885FABP5 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.