SCHEMBL21396461

SCHEMBL21396461

CCCSc1nc2c(=O)[nH]c(N)nc2n1CC(O)C1OP(S)OCC1O

nearest known ligand 0.35

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PNP P00491 4/20 0.35
TLR7 Q9NYK1 12/20 0.35
HPRT1 P00492 1/20 0.31
CYP3A4 P08684 1/20 0.31
MAPT P10636 1/20 0.31
POLB P06746 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
SCHEMBL21396384 0.80 TLR7 (0.35) PNPTLR7HPRT1CYP3A4MAPT
SCHEMBL21396502 0.71 PNP (0.37) PNPTLR7HPRT1CYP3A4MAPT
SCHEMBL21396531 0.70 PNP (0.33) PNPTLR7HPRT1CYP3A4MAPT
SCHEMBL21396412 0.67 PNP (0.36) PNPTLR7HPRT1
SCHEMBL12820574 0.67 PNP (0.50) PNPPOLB
SCHEMBL21396490 0.66 CYP3A4 (0.42) PNPTLR7HPRT1CYP3A4MAPT
SCHEMBL21396411 0.66 RXFP1 (0.40) MAPTPOLB
SCHEMBL21396466 0.66 CYP3A4 (0.35) PNPTLR7HPRT1CYP3A4MAPT
SCHEMBL21396508 0.66 PNP (0.36) PNPTLR7HPRT1CYP3A4MAPT
SCHEMBL21396396 0.64 MAPT (0.48) PNPCYP3A4MAPT

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-20190292214-A1 NEW EQUATORIALLY MODIFIED POLYMER LINKED MULTIMERS OF GUANOSINE-3', 5'-CYCLIC MONOPHOSPHATES MIRECA MEDICINES GMBH (DE) 2019-09-26 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-20190292214-A1 NEW EQUATORIALLY MODIFIED POLYMER LINKED MULTIMERS OF GUANOSINE-3', 5'-CYCLIC MONOPHOSPHATES PDE7A, PRKG1, PDE4C PNP 100/4885TLR7 4063/4885HPRT1 1856/4885

“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.