SCHEMBL1146086

SCHEMBL1146086

CCSCCCCCCCCCCCC(=O)O[C@H]1C[C@H](n2cc(C)c(=O)[nH]c2=O)O[C@@H]1CO

nearest known ligand 0.60

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
RNASE1 P07998 1/20 0.60
SLC6A2 P23975 1/20 0.60
TK2 O00142 3/20 0.55
TK1 P04183 4/20 0.52
ABCG2 Q9UNQ0 3/20 0.52
ABCB1 P08183 1/20 0.52

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
SCHEMBL16349867 0.91 RNASE1 (0.71) RNASE1SLC6A2TK2TK1ABCG2
SCHEMBL13901238 0.91 RNASE1 (0.71) RNASE1SLC6A2TK2TK1ABCG2
SCHEMBL8999382 0.90 TK2 (0.67) RNASE1SLC6A2TK2TK1ABCG2
SCHEMBL27790846 0.84 SLC6A2 (0.64) RNASE1SLC6A2TK2TK1ABCG2
SCHEMBL19407973 0.84 RNASE1 (0.71) RNASE1SLC6A2TK2TK1
SCHEMBL774263 0.84 RNASE1 (0.68) RNASE1SLC6A2TK2TK1
SCHEMBL16287348 0.84 RNASE1 (0.68) RNASE1SLC6A2TK2TK1
SCHEMBL14681227 0.84 RNASE1 (0.68) RNASE1SLC6A2TK2TK1
SCHEMBL3337696 0.84 RNASE1 (0.71) RNASE1SLC6A2TK2TK1
SCHEMBL767324 0.84 RNASE1 (0.68) RNASE1SLC6A2TK2TK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110039798-A1 SUBSTITUTED NUCLEOSIDE DERIVATIVES WITH ANTIVIRAL AND ANTIMICROBIAL PROPERTIES EASTERN VIRGINIA MEDICAL SCHOOL (US) 2011-02-17 US disclosed

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-20110039798-A1 SUBSTITUTED NUCLEOSIDE DERIVATIVES WITH ANTIVIRAL AND ANTIMICROBIAL PROPERTIES SAMHD1, TLR3, MAVS RNASE1 631/4885SLC6A2 2383/4885TK2 218/4885

“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.