SCHEMBL23920980

SCHEMBL23920980

CCOC(=O)CCCSc1nc2c(=O)[nH]c(N)nc2n1CCO

nearest known ligand 0.43

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PNP P00491 5/20 0.43
PTGDR2 Q9Y5Y4 4/20 0.43
HPGD P15428 4/20 0.41
ALDH1A1 P00352 3/20 0.40
MAPK1 P28482 1/20 0.40
HPRT1 P00492 2/20 0.39
MAPT P10636 1/20 0.38
TK1 P04183 1/20 0.38
MEN1 O00255 1/20 0.37
GAA P10253 1/20 0.37
KMT2A Q03164 1/20 0.37
HSD17B10 Q99714 1/20 0.35

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
SCHEMBL21396394 0.77 PNP (0.51) PNPHPGDALDH1A1HPRT1MAPT
SCHEMBL21396398 0.76 PNP (0.52) PNPALDH1A1HPRT1MAPTTK1
SCHEMBL21396401 0.75 PNP (0.42) PNPHPRT1MAPTTK1HSD17B10
SCHEMBL21396435 0.73 PNP (0.42) PNPHPGDALDH1A1MAPK1TK1
SCHEMBL21396481 0.71 MEN1 (0.44) PNPHPGDALDH1A1MAPK1MAPT
SCHEMBL5256051 0.68 HPRT1 (0.65) PNPALDH1A1HPRT1TK1MEN1
SCHEMBL8437638 0.68 PNP (0.44) PNPHPGDALDH1A1MAPK1MEN1
SCHEMBL21396362 0.67 PNP (0.56) PNPALDH1A1HPRT1TK1MEN1
SCHEMBL21396414 0.67 PNP (0.47) PNPMAPTTK1KMT2AHSD17B10
SCHEMBL456162 0.67 MAPK1 (0.44) PNPHPGDALDH1A1MAPK1HPRT1

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 111/4885PTGDR2 1901/4885HPGD 938/4885
US-20210317156-A1 NEW POLYMER LINKED MULTIMERS OF GUANOSINE-3', 5'-CYCLIC MONOPHOSPHATES PRKG1, PRKG2, PDE7A PNP 106/4885PTGDR2 1843/4885HPGD 994/4885

“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.