SCHEMBL24913296

SCHEMBL24913296

CCC(=O)NCC(C)(C)SSCO[C@@H]1C[C@H](n2cnc3c(=O)[nH]c(N)nc32)OC1COP(=O)(O)OP(=O)(O)OP(=O)(O)O

nearest known ligand 0.51

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.51
P2RY2 P41231 1/20 0.48
P2RY4 P51582 1/20 0.48
P2RY6 Q15077 1/20 0.48
KRAS P01116 9/20 0.48
FUT5 Q11128 1/20 0.47
TGM2 P21980 1/20 0.45
FUT6 P51993 1/20 0.42
POLG P54098 1/20 0.40
NT5E P21589 1/20 0.40

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
SCHEMBL24913374 0.92 POLB (0.47) POLBP2RY2P2RY4P2RY6KRAS
SCHEMBL24913351 0.92 POLB (0.47) POLBP2RY2P2RY4P2RY6KRAS
SCHEMBL21787165 0.91 POLB (0.47) POLBP2RY2P2RY4P2RY6KRAS
SCHEMBL24913350 0.91 POLB (0.47) POLBP2RY2P2RY4P2RY6KRAS
SCHEMBL19662616 0.90 POLB (0.55) POLBP2RY2P2RY4P2RY6KRAS
SCHEMBL21787190 0.90 POLB (0.58) POLBP2RY2P2RY4P2RY6KRAS
SCHEMBL23734250 0.90 POLB (0.58) POLBP2RY2P2RY4P2RY6KRAS
SCHEMBL23734156 0.90 POLB (0.58) POLBP2RY2P2RY4P2RY6KRAS
SCHEMBL21786819 0.89 P2RY1 (0.45) POLBP2RY6NT5E
SCHEMBL24913409 0.88 POLB (0.57) POLBP2RY2P2RY4P2RY6KRAS

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-20230028321-A1 NUCLEOTIDE DERIVATIVES AND METHODS OF USE THEREOF THE TRUSTEES OF COLUMBIA UNIVERSITY IN THE CITY OF NEW YORK (US) 2023-01-26 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-20230028321-A1 NUCLEOTIDE DERIVATIVES AND METHODS OF USE THEREOF POLRMT, NSUN2, NUDT1 POLB 11/4885P2RY2 1489/4885P2RY4 924/4885

“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.