SCHEMBL23921069

SCHEMBL23921069

O=c1c2nc(-c3ccc(O)cc3)n([C@@H]3OC4CO[PH](=O)O[C@H]4[C@@H]3O)c2nc2[nH]c(-c3ccccc3)cn12

nearest known ligand 0.56

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.56
ADORA3 P0DMS8 5/20 0.32
ADORA1 P30542 4/20 0.32
ADORA2A P29274 1/20 0.32
SIRT2 Q8IXJ6 1/20 0.31
SIRT1 Q96EB6 1/20 0.31
HSD17B10 Q99714 1/20 0.31
GAPDH P04406 1/20 0.31
MAT2A P31153 1/20 0.30
NADK O95544 1/20 0.30

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
SCHEMBL23921088 0.93 TDP1 (0.55) TDP1ADORA3ADORA1SIRT2SIRT1
SCHEMBL23920904 0.92 TDP1 (0.53) TDP1ADORA3ADORA1
SCHEMBL24775992 0.89 TDP1 (0.57) TDP1ADORA3ADORA1ADORA2A
SCHEMBL21396437 0.88 TDP1 (0.60) TDP1ADORA3ADORA1SIRT2SIRT1
SCHEMBL24775103 0.88 TDP1 (0.58) TDP1ADORA3ADORA1
SCHEMBL23921234 0.86 TDP1 (0.56) TDP1ADORA3ADORA1
SCHEMBL21396429 0.85 TDP1 (0.56) TDP1ADORA3ADORA1SIRT2SIRT1
SCHEMBL25932952 0.85 TDP1 (0.56) TDP1ADORA3ADORA1ADORA2ASIRT2
SCHEMBL25930859 0.85 TDP1 (0.56) TDP1ADORA3ADORA1ADORA2ASIRT2
SCHEMBL23920976 0.84 TDP1 (0.55) TDP1ADORA3ADORA1

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-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 (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-20210317156-A1 NEW POLYMER LINKED MULTIMERS OF GUANOSINE-3', 5'-CYCLIC MONOPHOSPHATES PRKG1, PRKG2, PDE7A TDP1 690/4885ADORA3 449/4885ADORA1 828/4885

“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.