SCHEMBL7079286

SCHEMBL7079286

CC(C)(C)c1ccccc1NC1=C(O)CC(CCc2ccccc2)(c2ccccc2)OC1=O

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 3/20 0.37
POLB P06746 2/20 0.37
THRB P10828 1/20 0.37
ALOX12 P18054 1/20 0.37
LDHA P00338 2/20 0.34
L3MBTL1 Q9Y468 2/20 0.34
ALDH1A1 P00352 2/20 0.33
PTGS1 P23219 1/20 0.33
PTGS2 P35354 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
SIRT2 Q8IXJ6 1/20 0.33
EGFR P00533 1/20 0.32
MEN1 O00255 1/20 0.31
MAPT P10636 1/20 0.31
PKM P14618 1/20 0.31
HPGD P15428 1/20 0.31
RECQL P46063 1/20 0.31
KMT2A Q03164 1/20 0.31
TSHR P16473 1/20 0.31
SMN1; SMN2 Q16637 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
SCHEMBL7074874 0.89 KDM4E (0.35) GAAPOLBLDHAL3MBTL1ALDH1A1
SCHEMBL7075965 0.86 KMT2A (0.37) GAAPOLBALOX12LDHAL3MBTL1
SCHEMBL6295561 0.84 LMNA (0.35) GAAALOX12LDHAL3MBTL1ALDH1A1
SCHEMBL7446283 0.82 LDHA (0.34) LDHAALDH1A1SIRT2EGFRMEN1
SCHEMBL7444885 0.78 GAA (0.34) GAALDHAL3MBTL1ALDH1A1TDP1
SCHEMBL8343092 0.74 EPHX2 (0.35) LDHAALDH1A1MEN1HPGDKMT2A
SCHEMBL6608872 0.73 LDHA (0.41) GAALDHAL3MBTL1EGFRMEN1
SCHEMBL6602959 0.73 LDHA (0.41) GAALDHAL3MBTL1EGFROPRM1
SCHEMBL7758845 0.72 LDHA (0.48) LDHA
SCHEMBL6609678 0.72 LDHA (0.40) GAALDHAL3MBTL1PTGS2EGFR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20030171425-A1 HIV protease inhibitors BOYER FREDERICK EARL (US) 2003-09-11 US claimed
US-6512006-B1 Novel 3-position Nitrogen substituted 6,6- disubstituted-5, 6-dihydropyrones and related compounds possess antiviral properties WARNER-LAMBERT COMPANY 2003-01-28 US claimed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 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-20030171425-A1 HIV protease inhibitors DNPEP, PRSS1, PREP GAA 743/4885POLB 2048/4885THRB 4796/4885

“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.