SCHEMBL21924557

SCHEMBL21924557

CC(C)n1cnc2c1N=CNC2

nearest known ligand 0.32

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 1/20 0.32
▸ ALDH1A1 P00352 1/20 0.32
▸ KMT2A Q03164 1/20 0.32
▸ ADORA2A P29274 2/20 0.30
▸ ADORA1 P30542 2/20 0.30
▸ ADORA2B P29275 1/20 0.30
▸ PI4KA P42356 1/20 0.30
▸ PI4K2B Q8TCG2 1/20 0.30
▸ PI4K2A Q9BTU6 1/20 0.30
▸ PI4KB Q9UBF8 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
SCHEMBL21925853 0.73 — —
SCHEMBL18416502 0.70 — —
SCHEMBL23641712 0.70 ADORA2A (0.35) MEN1ALDH1A1KMT2AADORA2AADORA1
SCHEMBL21924820 0.67 — —
SCHEMBL22650902 0.66 SIGMAR1 (0.34) MEN1ALDH1A1KMT2A
SCHEMBL15357766 0.64 MAPK13 (0.33) MEN1ALDH1A1KMT2AADORA2AADORA1
SCHEMBL21347418 0.64 MEN1 (0.31) MEN1ALDH1A1KMT2A
SCHEMBL19660823 0.63 MEN1 (0.30) MEN1ALDH1A1KMT2A
SCHEMBL21137434 0.63 ADORA2A (0.32) MEN1ALDH1A1KMT2AADORA2AADORA1
SCHEMBL7078751 0.63 — —

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11773132-B2 Cyclic di-nucleotides as stimulator of interferon genes modulators BEIJING XUANYI PHARMASCIENCES CO., LTD. (CN) 2023-10-03 — — US disclosed
US-11161864-B2 Sting agonists Venenum Biodesign, LLC (US) 2021-11-02 — — US disclosed
US-20200331957-A1 CYCLIC DI-NUCLEOTIDES AS STIMULATOR OF INTERFERON GENES MODULATORS AJ SCIENCES (YIXING) CO., LTD (CN) 2020-10-22 — — US disclosed
US-20200291096-A1 BICYCLIC PEPTIDE LIGAND STING CONJUGATES AND USES THEREOF Bicyclerd Limited (GB) 2020-09-17 — — US disclosed
US-20200131209-A1 NOVEL STING AGONISTS Venenum Biodesign, LLC 2020-04-30 — — 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-20200291096-A1 BICYCLIC PEPTIDE LIGAND STING CONJUGATES AND USES THEREOF STING1, BID, VIP MEN1 1257/4885ALDH1A1 4871/4885KMT2A 3919/4885
US-20200131209-A1 NOVEL STING AGONISTS STING1, CGAS, TBK1 MEN1 1929/4885ALDH1A1 4836/4885KMT2A 3656/4885
US-11161864-B2 Sting agonists STING1, IRF3, CGAS MEN1 1416/4885ALDH1A1 4840/4885KMT2A 3694/4885
US-20200331957-A1 CYCLIC DI-NUCLEOTIDES AS STIMULATOR OF INTERFERON GENES MODULATORS STING1, IRF3, CGAS MEN1 4490/4885ALDH1A1 3483/4885KMT2A 1936/4885
US-11773132-B2 Cyclic di-nucleotides as stimulator of interferon genes modulators STING1, IRF3, CGAS MEN1 4490/4885ALDH1A1 3483/4885KMT2A 1936/4885

“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.

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