SCHEMBL23920863

SCHEMBL23920863

Nc1nc2c(nc(SCc3ccc4ccccc4c3Br)n2CCO)c(=O)[nH]1

nearest known ligand 0.47

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PNP P00491 8/20 0.41
TK1 P04183 1/20 0.36
DHFR P00374 1/20 0.36
TYMS P04818 2/20 0.35
NOS1 P29475 1/20 0.35
PDE7A Q13946 1/20 0.35
PDE7B Q9NP56 1/20 0.35
SLC12A2 P55011 1/20 0.34
KMT2A Q03164 1/20 0.34
SLC12A5 Q9H2X9 1/20 0.34
KDM4E B2RXH2 1/20 0.34
USP2 O75604 1/20 0.34
ALDH1A1 P00352 1/20 0.34
TSHR P16473 1/20 0.34
HSD17B10 Q99714 1/20 0.34

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
SCHEMBL23920830 0.80 PNP (0.43) PNPTK1DHFRKMT2AALDH1A1
SCHEMBL23920921 0.76 PNP (0.44) PNPTK1USP2TSHRHSD17B10
SCHEMBL23921225 0.76 PNP (0.55) PNPALDH1A1TSHRHSD17B10
SCHEMBL23920795 0.76 PNP (0.52) PNPTK1USP2TSHRHSD17B10
SCHEMBL23920942 0.74 PNP (0.50) PNPTK1USP2TSHRHSD17B10
SCHEMBL23921113 0.74 PNP (0.50) PNPTK1USP2ALDH1A1TSHR
SCHEMBL23921136 0.74 PNP (0.42) PNPTK1USP2ALDH1A1TSHR
SCHEMBL23920867 0.74 PNP (0.52) PNPALDH1A1TSHRHSD17B10
SCHEMBL23920936 0.74 PNP (0.46) PNPTK1USP2TSHRHSD17B10
SCHEMBL25932075 0.73 KDM4E (0.45) PNPTK1KDM4EALDH1A1

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 111/4885TK1 460/4885DHFR 2931/4885
US-20210317156-A1 NEW POLYMER LINKED MULTIMERS OF GUANOSINE-3', 5'-CYCLIC MONOPHOSPHATES PRKG1, PRKG2, PDE7A PNP 106/4885TK1 536/4885DHFR 3047/4885

“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.