SCHEMBL25358797

SCHEMBL25358797

CN(C(=O)OCC1c2ccccc2-c2ccccc21)C(CCc1ccccn1)C(=O)O

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HDAC1 Q13547 1/20 0.38
HDAC2 Q92769 1/20 0.38
FABP5 Q01469 3/20 0.38
FABP7 O15540 2/20 0.38
KDM4E B2RXH2 4/20 0.37
ALDH1A1 P00352 3/20 0.37
EPHX2 P34913 1/20 0.36
PTPRA P18433 1/20 0.36
KMT2A Q03164 2/20 0.36
MDM4 O15151 1/20 0.36
TP53 P04637 1/20 0.36
CYP1A2 P05177 1/20 0.36
CYP3A4 P08684 1/20 0.36
CYP2D6 P10635 1/20 0.36
CYP2C9 P11712 1/20 0.36
TSHR P16473 1/20 0.36
CYP2C19 P33261 1/20 0.36
CASP3 P42574 1/20 0.36
NPC1 O15118 1/20 0.36
LMNA P02545 1/20 0.36

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
SCHEMBL25358794 1.00 HDAC1 (0.38) HDAC1HDAC2FABP5FABP7KDM4E
SCHEMBL29633641 0.91 PTPRA (0.42) HDAC1HDAC2FABP5FABP7EPHX2
SCHEMBL21837958 0.86 FABP5 (0.41) FABP5FABP7EPHX2KMT2ACASP3
SCHEMBL21837960 0.86 FABP5 (0.41) FABP5FABP7EPHX2KMT2ACASP3
SCHEMBL30889958 0.86 FABP5 (0.41) FABP5FABP7EPHX2KMT2ACASP3
SCHEMBL30792879 0.86 FABP5 (0.41) FABP5FABP7EPHX2KMT2ACASP3
SCHEMBL25185783 0.85 FABP5 (0.38) FABP5FABP7EPHX2KMT2AMDM4
SCHEMBL25183016 0.85 FABP5 (0.38) FABP5FABP7EPHX2KMT2AMDM4
SCHEMBL25355859 0.85 MDM2 (0.41) FABP5FABP7EPHX2KMT2AMDM4
SCHEMBL25355853 0.85 MDM2 (0.41) FABP5FABP7EPHX2KMT2AMDM4

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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230257343-A1 NOVEL AMINO ACID DERIVATIVES PEPTIDREAM INC (JP) 2023-08-17 US claimed
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-20230257343-A1 NOVEL AMINO ACID DERIVATIVES PEPTIDREAM INC (JP) 2023-08-17 US disclosed
US-20230257343-A1 NOVEL AMINO ACID DERIVATIVES PEPTIDREAM INC (JP) 2023-08-17 US disclosed
US-20230257343-A1 NOVEL AMINO ACID DERIVATIVES PEPTIDREAM INC (JP) 2023-08-17 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 (4 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 HDAC1 1866/4885HDAC2 2251/4885FABP5 608/4885
US-20230257343-A1 NOVEL AMINO ACID DERIVATIVES DNPEP, BCAT1, ANPEP HDAC1 4555/4885HDAC2 4644/4885FABP5 767/4885
US-20220144762-A1 METHOD FOR PREPARING AROMATIC AMINO ACID DERIVATIVE DDC, AADAT, TYR HDAC1 1866/4885HDAC2 2251/4885FABP5 608/4885
US-12071396-B2 Method for preparing aromatic amino acid derivative DDC, AADAT, TYR HDAC1 1866/4885HDAC2 2251/4885FABP5 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.