SCHEMBL19033992

SCHEMBL19033992

CCC(C)(C)n1cnc2c(=O)[nH]cnc21

nearest known ligand 0.47

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
HPRT1 P00492 10/20 0.47
PNP P00491 2/20 0.46
LMNA P02545 2/20 0.40
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
PI4KA P42356 1/20 0.40
PI4K2B Q8TCG2 1/20 0.40
PI4K2A Q9BTU6 1/20 0.40
PI4KB Q9UBF8 1/20 0.40
PDE4A P27815 1/20 0.40
ADORA2A P29274 1/20 0.40
PDE4B Q07343 1/20 0.40
PDE4C Q08493 1/20 0.40
PDE4D Q08499 1/20 0.40
ALDH1A1 P00352 1/20 0.40
ALB P02768 1/20 0.40
MAPK1 P28482 1/20 0.40

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
SCHEMBL24767723 0.88 PNP (0.47) HPRT1PNPLMNAMEN1KMT2A
SCHEMBL23774611 0.88 HPRT1 (0.47) HPRT1PNPLMNAMEN1KMT2A
SCHEMBL23934886 0.86 PNP (0.46) HPRT1PNPLMNAMEN1KMT2A
SCHEMBL13657243 0.84 PI4KA (0.51) HPRT1PNPLMNAMEN1KMT2A
SCHEMBL21372049 0.84 PNP (0.44) HPRT1PNPLMNAMEN1KMT2A
SCHEMBL22883459 0.81 HPRT1 (0.46) HPRT1PNPLMNAMEN1KMT2A
SCHEMBL21417467 0.79 PNP (0.46) HPRT1PNPLMNAMEN1KMT2A
SCHEMBL18769787 0.78 MEN1 (0.51) HPRT1PNPLMNAMEN1KMT2A
SCHEMBL23476793 0.75 MEN1 (0.35) PNPMEN1KMT2API4KAPI4K2B
SCHEMBL1993930 0.74 HPRT1 (0.63) HPRT1PNPLMNAMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11787833-B2 Modified cyclic dinucleoside compounds as sting modulators ALIGOS THERAPEUTICS, INC. (US) 2023-10-17 US disclosed
US-20210277046-A1 CYCLIC DINUCLEOTIDES AS STING AGONISTS JANSSEN PHARMACEUTICA NV (BE) 2021-09-09 US disclosed
US-10927394-B2 Methods and reagents for synthesising polynucleotide molecules OXFORD NANOPORE TECHNOLOGIES LIMITED (GB) 2021-02-23 US disclosed
US-20200369711-A1 MODIFIED CYCLIC DINUCLEOSIDE COMPOUNDS AS STING MODULATORS ALIGOS THERAPEUTICS, INC. 2020-11-26 US disclosed
US-20190352687-A1 METHODS AND REAGENTS FOR SYNTHESISING POLYNUCLEOTIDE MOLECULES OXFORD NANOPORE TECHNOLOGIES LIMITED (GB) 2019-11-21 US disclosed
US-20190300561-A1 METHODS OF SYNTHESIZING SUBSTITUTED PURINE COMPOUNDS Epizyme, Inc. 2019-10-03 US disclosed
US-20190185511-A1 LOCKED NUCLEIC ACID CYCLIC DINUCLEOTIDE COMPOUNDS AND USES THEREOF Aduro Biotech, Inc. (US) 2019-06-20 US disclosed
US-9688714-B2 Substituted purine compounds Epizyme, Inc. (US) 2017-06-27 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 (5 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-20190185511-A1 LOCKED NUCLEIC ACID CYCLIC DINUCLEOTIDE COMPOUNDS AND USES THEREOF STING1, TLR9, IFNAR1 HPRT1 323/4885PNP 182/4885LMNA 474/4885
US-20210277046-A1 CYCLIC DINUCLEOTIDES AS STING AGONISTS STING1, CGAS, IFNAR1 HPRT1 357/4885PNP 319/4885LMNA 653/4885
US-20200369711-A1 MODIFIED CYCLIC DINUCLEOSIDE COMPOUNDS AS STING MODULATORS STING1, CGAS, IRF3 HPRT1 380/4885PNP 95/4885LMNA 825/4885
US-20190300561-A1 METHODS OF SYNTHESIZING SUBSTITUTED PURINE COMPOUNDS MECP2, DOT1L, DNMT1 HPRT1 212/4885PNP 66/4885LMNA 3565/4885
US-11787833-B2 Modified cyclic dinucleoside compounds as sting modulators STING1, CGAS, IRF3 HPRT1 380/4885PNP 95/4885LMNA 825/4885

“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.