SCHEMBL7077918

SCHEMBL7077918

CCCN(C1=C(O)CC(CCc2ccccc2)(c2ccccc2)OC1=O)c1cccc(CC)c1

nearest known ligand 0.36

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
UTS2R Q9UKP6 8/20 0.36
HCAR3 P49019 1/20 0.34
HCAR2 Q8TDS4 1/20 0.34
OPRM1 P35372 4/20 0.33
DRD2 P14416 2/20 0.33
DRD3 P35462 2/20 0.33
OPRD1 P41143 2/20 0.33
OPRK1 P41145 2/20 0.33
LDHA P00338 2/20 0.32
SIGMAR1 Q99720 2/20 0.31
OPRL1 P41146 2/20 0.31
POLB P06746 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
SCHEMBL7079765 0.94 UTS2R (0.36) UTS2ROPRM1DRD2DRD3OPRD1
SCHEMBL7074566 0.92 LDHA (0.35) UTS2ROPRM1DRD2DRD3OPRD1
SCHEMBL7077656 0.92 UTS2R (0.36) UTS2ROPRM1DRD2DRD3OPRD1
SCHEMBL7073406 0.89 UTS2R (0.34) UTS2ROPRM1DRD2DRD3OPRD1
SCHEMBL7077562 0.86 OPRM1 (0.34) UTS2ROPRM1DRD2DRD3OPRD1
SCHEMBL7143558 0.86 MTNR1A (0.37) UTS2R
SCHEMBL7079182 0.86 PPIB (0.34) UTS2RDRD2LDHA
SCHEMBL7075170 0.84 LDHA (0.36) UTS2ROPRM1LDHAOPRL1
SCHEMBL7078600 0.83 NPSR1 (0.38) OPRM1OPRD1OPRK1LDHASIGMAR1
SCHEMBL7073418 0.83 LDHA (0.38) UTS2ROPRM1LDHAOPRL1

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 UTS2R 3413/4885HCAR3 3195/4885HCAR2 4396/4885

“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.