SCHEMBL14946291

SCHEMBL14946291

CC[C@@]1(C)O[C@@H](n2ccc(=O)[nH]c2=O)C(OC(=O)c2ccccc2)[C@H]1OC(=O)c1ccccc1

nearest known ligand 0.43

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.43
MEN1 O00255 1/20 0.43
USP2 O75604 1/20 0.43
KMT2A Q03164 1/20 0.43
P2RY2 P41231 3/20 0.39
P2RY12 Q9H244 1/20 0.39
ABCB1 P08183 4/20 0.38
RNASE1 P07998 1/20 0.38
TDP1 Q9NUW8 1/20 0.37
HSD17B10 Q99714 1/20 0.37
GAA P10253 1/20 0.37
SLC28A1 O00337 1/20 0.36
SLC28A2 O43868 1/20 0.36
SLC29A1 Q99808 1/20 0.36
SLC28A3 Q9HAS3 1/20 0.36
NT5E P21589 1/20 0.36
P2RY4 P51582 1/20 0.36
CES2 O00748 1/20 0.36
SLC43A1 O75387 1/20 0.36

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
SCHEMBL14929356 1.00 POLB (0.43) POLBMEN1USP2KMT2AP2RY2
SCHEMBL14853834 0.91 POLB (0.44) POLBMEN1USP2KMT2AP2RY2
SCHEMBL18574250 0.91 POLB (0.44) POLBMEN1USP2KMT2AP2RY2
SCHEMBL19590451 0.91 POLB (0.44) POLBMEN1USP2KMT2AP2RY2
SCHEMBL15841051 0.84 POLB (0.43) POLBMEN1USP2KMT2AP2RY2
SCHEMBL15841050 0.83 POLB (0.42) POLBMEN1USP2KMT2AP2RY2
SCHEMBL13592076 0.83 POLB (0.39) POLBMEN1USP2KMT2AP2RY2
SCHEMBL9893412 0.81 POLB (0.40) POLBMEN1USP2KMT2AP2RY2
SCHEMBL9893411 0.81 POLB (0.40) POLBMEN1USP2KMT2AP2RY2
SCHEMBL15837285 0.80 POLB (0.42) 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-20130123481-A1 MODIFIED NUCLEOSIDES, NUCLEOTIDES, AND NUCLEIC ACIDS, AND USES THEREOF modeRNA Therapeutics (US) 2013-05-16 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-20130123481-A1 MODIFIED NUCLEOSIDES, NUCLEOTIDES, AND NUCLEIC ACIDS, AND USES THEREOF ADAR, NT5C3B, NSUN2 POLB 125/4885MEN1 2176/4885USP2 4012/4885

“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.