SCHEMBL24239249

SCHEMBL24239249

NCn1cnc2c(=O)[nH]cnc21

nearest known ligand 0.63

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
HPRT1 P00492 15/20 0.63
PNP P00491 2/20 0.55
MEN1 O00255 1/20 0.53
LMNA P02545 1/20 0.53
KMT2A Q03164 1/20 0.53

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
SCHEMBL1993930 0.83 HPRT1 (0.63) HPRT1PNPMEN1LMNAKMT2A
SCHEMBL20782416 0.80 HPRT1 (0.65) HPRT1PNP
SCHEMBL11258920 0.80 HPRT1 (0.69) HPRT1PNP
SCHEMBL27670854 0.80 HPRT1 (0.56) HPRT1PNPMEN1LMNAKMT2A
SCHEMBL22381490 0.79 HPRT1 (0.63) HPRT1PNPMEN1LMNAKMT2A
SCHEMBL455645 0.79 HPRT1 (0.62) HPRT1PNPMEN1LMNAKMT2A
SCHEMBL7569894 0.79 HPRT1 (0.58) HPRT1PNPMEN1LMNAKMT2A
SCHEMBL3060815 0.79 HPRT1 (0.63) HPRT1PNP
SCHEMBL18521979 0.77 PNP (0.66) HPRT1PNPMEN1LMNAKMT2A
SCHEMBL13145301 0.77 HPRT1 (0.51) HPRT1PNPMEN1LMNAKMT2A

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-11685761-B2 Cyclic di-nucleotide compounds as sting agonists MERCK SHARP & DOHME LLC (US) 2023-06-27 US disclosed
US-20220033435-A1 Cyclic Di-Nucleotide Compounds as STING Agonists MERCK SHARP & DOHME CORP. (US) 2022-02-03 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-20220033435-A1 Cyclic Di-Nucleotide Compounds as STING Agonists STING1, CGAS, IFNAR1 HPRT1 226/4885PNP 384/4885MEN1 1605/4885
US-11685761-B2 Cyclic di-nucleotide compounds as sting agonists STING1, CGAS, IFNAR1 HPRT1 274/4885PNP 462/4885MEN1 1971/4885

“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.