SCHEMBL7074874

SCHEMBL7074874

Cc1ccc(C(C)(C)C)c(NC2=C(O)CC(CCc3ccccc3)(c3ccccc3)OC2=O)c1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.35
KMT2A Q03164 2/20 0.35
GAA P10253 2/20 0.35
L3MBTL1 Q9Y468 2/20 0.35
MEN1 O00255 1/20 0.35
ALDH1A1 P00352 1/20 0.35
MAPT P10636 1/20 0.35
PKM P14618 1/20 0.35
MAPK1 P28482 1/20 0.35
HTT P42858 1/20 0.35
MCL1 Q07820 1/20 0.35
ASAH1 Q13510 2/20 0.35
POLB P06746 3/20 0.33
LMNA P02545 1/20 0.33
RAB9A P51151 2/20 0.32
LDHA P00338 2/20 0.32
CXCR2 P25025 1/20 0.32
IDO1 P14902 1/20 0.31
PTGS1 P23219 1/20 0.31
PTGS2 P35354 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
SCHEMBL7079286 0.89 GAA (0.37) KMT2AGAAL3MBTL1MEN1ALDH1A1
SCHEMBL7075965 0.82 KMT2A (0.37) KDM4EKMT2AGAAL3MBTL1ALDH1A1
SCHEMBL7130504 0.82 LDHA (0.38) KDM4EKMT2AGAAL3MBTL1MEN1
SCHEMBL7758845 0.80 LDHA (0.48) ASAH1LDHA
SCHEMBL6295561 0.78 LMNA (0.35) KDM4EKMT2AGAAL3MBTL1MEN1
SCHEMBL7446283 0.76 LDHA (0.34) KMT2AMEN1ALDH1A1MAPTPKM
SCHEMBL7444885 0.73 GAA (0.34) KDM4EGAAL3MBTL1ALDH1A1MAPK1
SCHEMBL6608780 0.72 NPC1 (0.36) KDM4EKMT2AL3MBTL1MEN1ALDH1A1
SCHEMBL6608872 0.72 LDHA (0.41) KDM4EKMT2AGAAL3MBTL1MEN1
SCHEMBL8008687 0.71 LDHA (0.41) LDHA

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 KDM4E 1481/4885KMT2A 2806/4885GAA 743/4885

“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.