SCHEMBL29633873

SCHEMBL29633873

COc1ccc(CCC(C(=O)O)N(C)C(=O)OCC2c3ccccc3-c3ccccc32)cc1OC

nearest known ligand 0.44

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
FABP5 Q01469 1/20 0.44
ALDH1A1 P00352 2/20 0.42
KDM4E B2RXH2 1/20 0.42
KMT2A Q03164 2/20 0.42
THRB P10828 1/20 0.41
LDHA P00338 1/20 0.41
ADRB2 P07550 3/20 0.41
ADRB1 P08588 3/20 0.41
ADRB3 P13945 3/20 0.41
CHRM5 P08912 4/20 0.41
CHRM1 P11229 4/20 0.41
CHRM3 P20309 4/20 0.41
STAT3 P40763 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.39

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
SCHEMBL31369666 1.00 FABP5 (0.44) FABP5ALDH1A1KDM4EKMT2ATHRB
SCHEMBL29633794 0.93 CHRM5 (0.42) FABP5ALDH1A1KDM4EKMT2ALDHA
SCHEMBL25358236 0.90 LDHA (0.48) FABP5ALDH1A1KDM4EKMT2ATHRB
SCHEMBL25358230 0.90 LDHA (0.48) FABP5ALDH1A1KDM4EKMT2ATHRB
SCHEMBL29633858 0.89 PPARA (0.40) FABP5KMT2ATHRB
SCHEMBL29633852 0.89 FABP5 (0.39) FABP5ALDH1A1KDM4EKMT2ATHRB
SCHEMBL22091956 0.88 FABP5 (0.39) FABP5ALDH1A1KMT2ATHRBL3MBTL1
SCHEMBL22091955 0.88 FABP5 (0.39) FABP5ALDH1A1KMT2ATHRBL3MBTL1
SCHEMBL31370225 0.88 FABP5 (0.47) FABP5ALDH1A1KMT2A
SCHEMBL29633800 0.88 FABP5 (0.47) FABP5ALDH1A1KMT2A

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 FABP5 608/4885ALDH1A1 1120/4885KDM4E 626/4885
US-20220144762-A1 METHOD FOR PREPARING AROMATIC AMINO ACID DERIVATIVE DDC, AADAT, TYR FABP5 608/4885ALDH1A1 1120/4885KDM4E 626/4885
US-12071396-B2 Method for preparing aromatic amino acid derivative DDC, AADAT, TYR FABP5 608/4885ALDH1A1 1120/4885KDM4E 626/4885

“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.