SCHEMBL26534074

SCHEMBL26534074

CC1(C)O[C@H]2[C@H](n3cnc4c(=O)[nH]c(N)nc43)[C@H]3C[C@]3(CO)[C@H]2O1

nearest known ligand 0.67

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ ADORA3 P0DMS8 7/20 0.67
▸ HSP90AA1 P07900 1/20 0.43
▸ HSP90B1 P14625 1/20 0.43
▸ TK1 P04183 1/20 0.41
▸ HPGD P15428 1/20 0.41
▸ HTR2C P28335 1/20 0.41
▸ HTR2B P41595 1/20 0.41
▸ HRH2 P25021 1/20 0.41
▸ HTR5A P47898 1/20 0.41
▸ ADORA2A P29274 2/20 0.41
▸ STING1 Q86WV6 2/20 0.40
▸ PDE3B Q13370 1/20 0.40
▸ PDE3A Q14432 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
SCHEMBL22704957 0.91 ADORA3 (0.58) ADORA3TK1HPGDHRH2HTR5A
SCHEMBL12269824 0.81 ADORA3 (0.66) ADORA3HSP90AA1HSP90B1HTR2CHTR2B
SCHEMBL26534073 0.81 ADORA3 (1.00) ADORA3HSP90AA1HSP90B1HTR2CHTR2B
SCHEMBL12269794 0.79 HTR2B (0.55) ADORA3HSP90AA1HSP90B1HTR2CHTR2B
SCHEMBL19415065 0.79 HTR2B (0.55) ADORA3HSP90AA1HSP90B1HTR2CHTR2B
SCHEMBL29573575 0.79 HTR2B (0.47) ADORA3HSP90AA1HSP90B1HTR2CHTR2B
SCHEMBL22236552 0.78 ADORA3 (0.47) ADORA3TK1HPGDSTING1PDE3B
SCHEMBL15588481 0.78 ADORA3 (0.47) ADORA3TK1HPGDSTING1PDE3B
SCHEMBL12269843 0.74 ADORA3 (0.59) ADORA3HSP90AA1HSP90B1HTR2CHTR2B
SCHEMBL19938129 0.74 PI4KA (0.64) HPGDSTING1PDE3BPDE3A

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-11787833-B2 Modified cyclic dinucleoside compounds as sting modulators ALIGOS THERAPEUTICS, INC. (US) 2023-10-17 — — US disclosed
US-11787833-B2 Modified cyclic dinucleoside compounds as sting modulators ALIGOS THERAPEUTICS, INC. (US) 2023-10-17 — — 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-11787833-B2 Modified cyclic dinucleoside compounds as sting modulators STING1, CGAS, IRF3 ADORA3 378/4885HSP90AA1 2538/4885HSP90B1 1683/4885

“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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