SCHEMBL7077618

SCHEMBL7077618

CCCN(C1=C(O)CC(CCC2CCOC2)(c2ccc(OCCO)cc2)OC1=O)c1ccccc1

nearest known ligand 0.33

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TLR7 Q9NYK1 2/20 0.33
UTS2R Q9UKP6 2/20 0.33
LYN P07948 1/20 0.31
SRC P12931 1/20 0.31
BTK Q06187 1/20 0.31
GPR88 Q9GZN0 1/20 0.31
PRKAB2 O43741 1/20 0.31
PRKAG1 P54619 1/20 0.31
PRKAA2 P54646 1/20 0.31
PRKAA1 Q13131 1/20 0.31
PRKAG3 Q9UGI9 1/20 0.31
PRKAG2 Q9UGJ0 1/20 0.31
PRKAB1 Q9Y478 1/20 0.31
ALDH1A1 P00352 2/20 0.31
LMNA P02545 1/20 0.31
MAPT P10636 1/20 0.31
HSD17B10 Q99714 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
SCHEMBL7075204 0.91 UTS2R (0.35) UTS2RALDH1A1LMNAMAPTHSD17B10
SCHEMBL7074205 0.84 UTS2R (0.36) UTS2RMAPT
SCHEMBL7075153 0.79 LDHA (0.35) ALDH1A1LMNAMAPTHSD17B10
SCHEMBL7080696 0.79 LDHA (0.34) ALDH1A1LMNAMAPTHSD17B10
SCHEMBL7078827 0.79 DRD2 (0.34) UTS2RMAPT
SCHEMBL7077614 0.77 UTS2R (0.35) UTS2RMAPT
SCHEMBL7080444 0.74 LDHA (0.35) UTS2R
SCHEMBL7074622 0.74 UTS2R (0.33) UTS2R
SCHEMBL7074566 0.72 LDHA (0.35) UTS2R
SCHEMBL7137147 0.71 LTA4H (0.41) ALDH1A1LMNAMAPT

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 TLR7 4372/4885UTS2R 3413/4885LYN 3854/4885

“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.