SCHEMBL20434944

SCHEMBL20434944

COC1C(CO[Si](C)(C)C(C)(C)C)OC(n2cnc3c(=O)[nH]c(NC(=O)C(C)C)nc32)C1O

nearest known ligand 0.54

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ TAS1R3 Q7RTX0 1/20 0.53
▸ TAS1R1 Q7RTX1 1/20 0.53
▸ KDM4E B2RXH2 1/20 0.48
▸ IMPDH2 P12268 5/20 0.44
▸ IMPDH1 P20839 1/20 0.44
▸ HINT1 P49773 5/20 0.43
▸ HPGD P15428 1/20 0.42
▸ ALDH1A1 P00352 1/20 0.40
▸ NT5E P21589 1/20 0.40
▸ KRAS P01116 1/20 0.39
▸ GSK3A P49840 1/20 0.39
▸ RPS6KA3 P51812 1/20 0.39
▸ MAPK14 Q16539 1/20 0.39

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
SCHEMBL22883219 0.92 TAS1R3 (0.62) TAS1R3TAS1R1KDM4EIMPDH2IMPDH1
SCHEMBL22883221 0.92 KDM4E (0.48) TAS1R3TAS1R1KDM4EIMPDH2IMPDH1
SCHEMBL25613001 0.92 KDM4E (0.48) TAS1R3TAS1R1KDM4EIMPDH2IMPDH1
SCHEMBL22034192 0.90 TAS1R3 (0.54) TAS1R3TAS1R1KDM4EIMPDH2IMPDH1
SCHEMBL29881515 0.90 TAS1R3 (0.54) TAS1R3TAS1R1KDM4EIMPDH2IMPDH1
SCHEMBL27216192 0.90 TAS1R3 (0.54) TAS1R3TAS1R1KDM4EIMPDH2IMPDH1
SCHEMBL18490364 0.90 TAS1R3 (0.54) TAS1R3TAS1R1KDM4EIMPDH2IMPDH1
SCHEMBL25107034 0.89 TAS1R3 (0.53) TAS1R3TAS1R1KDM4EIMPDH2IMPDH1
SCHEMBL29664919 0.89 TAS1R3 (0.53) TAS1R3TAS1R1KDM4EIMPDH2IMPDH1
SCHEMBL29870610 0.89 TAS1R3 (0.53) TAS1R3TAS1R1KDM4EIMPDH2IMPDH1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230146410-A1 CYCLIC DINUCLEOTIDES AS STING AGONISTS JANSSEN BIOTECH INC (US) 2023-05-11 — — US disclosed
EP-3573718-B1 CYCLIC DINUCLEOTIDES AS STING AGONISTS JANSSEN BIOTECH INC (US) 2022-06-01 — — EP disclosed
WO-2018138685-A2 CYCLIC DINUCLEOTIDES AS STING AGONISTS JANSSEN BIOTECH, INC. (US) 2018-08-02 — — WO 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-20230146410-A1 CYCLIC DINUCLEOTIDES AS STING AGONISTS STING1, CGAS, MAVS TAS1R3 556/4885TAS1R1 302/4885KDM4E 3901/4885

“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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