SCHEMBL29633742

SCHEMBL29633742

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

nearest known ligand 0.35

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 1/20 0.34
MDM2 Q00987 2/20 0.33
PTGIR P43119 1/20 0.33
KMT2A Q03164 1/20 0.31
MMP13 P45452 1/20 0.31
FABP5 Q01469 2/20 0.31
MDM4 O15151 1/20 0.31
TP53 P04637 1/20 0.31
FABP7 O15540 1/20 0.31
IDO1 P14902 1/20 0.31
CYP11B1 P15538 1/20 0.30
CYP11B2 P19099 1/20 0.30

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 0.91 PTGIR (0.33) EPHX2MDM2PTGIRKMT2AFABP5
SCHEMBL29633808 0.91 PTGIR (0.33) EPHX2MDM2PTGIRKMT2AFABP5
SCHEMBL29634030 0.90 EPHX2 (0.33) EPHX2MDM2KMT2AMMP13FABP5
SCHEMBL29634027 0.90 HCRTR1 (0.34) EPHX2MDM2KMT2AMMP13FABP5
SCHEMBL29633690 0.90 EPHX2 (0.33) EPHX2MDM2KMT2AMMP13FABP5
SCHEMBL29633896 0.90 ADORA2A (0.36) EPHX2MDM2PTGIRKMT2AMMP13
SCHEMBL29633770 0.90 PTGIR (0.34) EPHX2MDM2PTGIRKMT2AMMP13
SCHEMBL29633954 0.89 MDM2 (0.36) EPHX2MDM2PTGIRKMT2AFABP5
SCHEMBL29633750 0.89 MDM2 (0.34) EPHX2MDM2KMT2AMMP13FABP5
SCHEMBL22454857 0.88 CYP3A4 (0.35) MDM2

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 EPHX2 2165/4885MDM2 223/4885PTGIR 4370/4885
US-20220144762-A1 METHOD FOR PREPARING AROMATIC AMINO ACID DERIVATIVE DDC, AADAT, TYR EPHX2 2165/4885MDM2 223/4885PTGIR 4370/4885
US-12071396-B2 Method for preparing aromatic amino acid derivative DDC, AADAT, TYR EPHX2 2165/4885MDM2 223/4885PTGIR 4370/4885

“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.