SCHEMBL26534073

SCHEMBL26534073

Nc1nc2c(ncn2[C@H]2[C@H](O)[C@H](O)[C@@]3(CO)C[C@H]23)c(=O)[nH]1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ ADORA3 P0DMS8 14/20 1.00
▸ HSP90AA1 P07900 1/20 0.64
▸ HSP90B1 P14625 1/20 0.64
▸ ADORA2A P29274 5/20 0.62
▸ HTR2B P41595 7/20 0.57
▸ HTR2C P28335 6/20 0.57
▸ TMIGD3 P0DMS9 3/20 0.57
▸ ADORA1 P30542 7/20 0.53
▸ TMEM97 Q5BJF2 1/20 0.53
▸ SIGMAR1 Q99720 1/20 0.53
▸ SLC6A3 Q01959 1/20 0.52
▸ TSPO P30536 1/20 0.50

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
SCHEMBL22704945 0.90 ADORA3 (0.81) ADORA3HSP90AA1HSP90B1ADORA2AHTR2B
SCHEMBL26534074 0.81 ADORA3 (0.67) ADORA3HSP90AA1HSP90B1ADORA2AHTR2B
SCHEMBL22704946 0.80 ADORA3 (0.66) ADORA3HSP90AA1HSP90B1ADORA2AHTR2B
SCHEMBL19459458 0.78 ADORA3 (0.77) ADORA3HSP90AA1HSP90B1ADORA2AHTR2B
SCHEMBL19464937 0.78 ADORA3 (0.77) ADORA3HSP90AA1HSP90B1ADORA2AHTR2B
SCHEMBL19464938 0.78 ADORA3 (0.77) ADORA3HSP90AA1HSP90B1ADORA2AHTR2B
SCHEMBL2363334 0.78 ADORA3 (1.00) ADORA3HSP90AA1HSP90B1ADORA2AHTR2B
SCHEMBL5816714 0.78 ADORA3 (0.82) ADORA3HSP90AA1HSP90B1ADORA2AHTR2B
SCHEMBL21710876 0.78 ADORA3 (1.00) ADORA3HSP90AA1HSP90B1ADORA2AHTR2B
SCHEMBL22933437 0.78 ADORA3 (0.77) ADORA3HSP90AA1HSP90B1ADORA2AHTR2B

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.

Send feedback