SCHEMBL23920830

SCHEMBL23920830

Nc1nc2c(nc(SCc3ccccc3B(O)O)n2CCO)c(=O)[nH]1

nearest known ligand 0.47

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PNP P00491 10/20 0.43
POLB P06746 2/20 0.38
TK1 P04183 1/20 0.38
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
ALDH1A1 P00352 2/20 0.36
HPGD P15428 2/20 0.36
MAPK1 P28482 1/20 0.36
DHFR P00374 1/20 0.36
HSD17B10 Q99714 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
SCHEMBL23921136 0.82 PNP (0.42) PNPTK1ALDH1A1HPGDHSD17B10
SCHEMBL23920862 0.81 PNP (0.43) PNPPOLBTK1KMT2A
SCHEMBL23920863 0.80 PNP (0.41) PNPTK1KMT2AALDH1A1DHFR
SCHEMBL23921113 0.79 PNP (0.50) PNPTK1ALDH1A1HPGDMAPK1
SCHEMBL23920921 0.79 PNP (0.44) PNPTK1HSD17B10
SCHEMBL23921225 0.79 PNP (0.55) PNPALDH1A1HPGDMAPK1HSD17B10
SCHEMBL23920795 0.78 PNP (0.52) PNPTK1HSD17B10
SCHEMBL23921066 0.77 XDH (0.46) PNPMEN1KMT2AHPGD
SCHEMBL23920942 0.76 PNP (0.50) PNPTK1HSD17B10
SCHEMBL23920794 0.76 PNP (0.46) PNPTK1MEN1KMT2AALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230242568-A1 POLYMER LINKED MULTIMERS OF GUANOSINE-3', 5'-CYCLIC MONOPHOSPHATES MIRECA MEDICINES GMBH (DE) 2023-08-03 US disclosed
US-20210317156-A1 NEW POLYMER LINKED MULTIMERS OF GUANOSINE-3', 5'-CYCLIC MONOPHOSPHATES MIRECA MEDICINES GMBH (DE) 2021-10-14 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 (2 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-20230242568-A1 POLYMER LINKED MULTIMERS OF GUANOSINE-3', 5'-CYCLIC MONOPHOSPHATES PRKG1, PRKG2, PRKAG3 PNP 111/4885POLB 1465/4885TK1 460/4885
US-20210317156-A1 NEW POLYMER LINKED MULTIMERS OF GUANOSINE-3', 5'-CYCLIC MONOPHOSPHATES PRKG1, PRKG2, PDE7A PNP 106/4885POLB 1528/4885TK1 536/4885

“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.