SCHEMBL800240

SCHEMBL800240

CC(C)[C@H]1O[C@@H](n2ccc(=O)[nH]c2=O)C(OC(=O)c2ccccc2)[C@@H]1C

nearest known ligand 0.46

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.46
MEN1 O00255 1/20 0.46
USP2 O75604 1/20 0.46
KMT2A Q03164 1/20 0.46
TDP1 Q9NUW8 2/20 0.45
P2RY2 P41231 2/20 0.41
P2RY12 Q9H244 1/20 0.41
HSD17B10 Q99714 1/20 0.39
SLC28A1 O00337 1/20 0.39
SLC28A2 O43868 1/20 0.39
SLC29A1 Q99808 1/20 0.39
SLC28A3 Q9HAS3 1/20 0.39
RNASE1 P07998 1/20 0.38

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
SCHEMBL800696 1.00 POLB (0.46) POLBMEN1USP2KMT2ATDP1
SCHEMBL13253090 0.87 TDP1 (0.47) POLBMEN1USP2KMT2ATDP1
SCHEMBL23710652 0.87 POLB (0.46) POLBMEN1USP2KMT2ATDP1
SCHEMBL805047 0.87 POLB (0.46) POLBMEN1USP2KMT2ATDP1
SCHEMBL25504886 0.85 MEN1 (0.51) POLBMEN1USP2KMT2AP2RY2
SCHEMBL25504874 0.85 MEN1 (0.51) POLBMEN1USP2KMT2AP2RY2
SCHEMBL25504929 0.85 MEN1 (0.51) POLBMEN1USP2KMT2AP2RY2
SCHEMBL12404717 0.85 SLC28A1 (0.53) POLBMEN1USP2KMT2AP2RY2
SCHEMBL16904879 0.85 MEN1 (0.51) POLBMEN1USP2KMT2AP2RY2
SCHEMBL12404716 0.85 MEN1 (0.51) POLBMEN1USP2KMT2AP2RY2

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-20120070411-A1 SUBSTITUTED NUCLEOTIDE ANALOGS ALIOS BIOPHARMA, INC. (US) 2012-03-22 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-20120070411-A1 SUBSTITUTED NUCLEOTIDE ANALOGS PNP, NTPCR, NUDT1 POLB 119/4885MEN1 1646/4885USP2 4612/4885

“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.