SCHEMBL7078683

SCHEMBL7078683

CC(C)N(C1=C(O)CC(CCc2ccccc2)(c2ccccc2)OC1=O)c1ccccc1

nearest known ligand 0.35

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
LDHA P00338 2/20 0.35
OPRM1 P35372 2/20 0.34
OPRL1 P41146 2/20 0.34
WRN Q14191 1/20 0.34
GAA P10253 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
EGFR P00533 1/20 0.33
ALDH1A1 P00352 2/20 0.33
UTS2R Q9UKP6 5/20 0.32
HSD11B1 P28845 1/20 0.32
NPC1 O15118 1/20 0.31
LMNA P02545 1/20 0.31
MAPT P10636 1/20 0.31
HTT P42858 1/20 0.31
RAB9A P51151 1/20 0.31
KMT2A Q03164 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
SCHEMBL7075213 0.88 OPRM1 (0.39) LDHAOPRM1OPRL1WRNGAA
SCHEMBL7079838 0.85 LDHA (0.38) LDHAOPRM1OPRL1WRNGAA
SCHEMBL7075398 0.85 LDHA (0.34) LDHAOPRM1OPRL1WRNGAA
SCHEMBL7445214 0.84 LDHA (0.35) LDHAOPRM1OPRL1WRNGAA
SCHEMBL7446274 0.83 LDHA (0.36) LDHAOPRM1OPRL1GAAL3MBTL1
SCHEMBL7075170 0.83 LDHA (0.36) LDHAOPRM1OPRL1WRNGAA
SCHEMBL7075144 0.83 LDHA (0.37) LDHAOPRM1OPRL1WRNGAA
SCHEMBL7074566 0.82 LDHA (0.35) LDHAOPRM1OPRL1WRNGAA
SCHEMBL7073418 0.80 LDHA (0.38) LDHAOPRM1OPRL1WRNGAA
SCHEMBL7077455 0.80 UTS2R (0.41) LDHAOPRM1OPRL1WRNGAA

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 LDHA 2167/4885OPRM1 3843/4885OPRL1 3562/4885

“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.