SCHEMBL22883221

SCHEMBL22883221

CO[C@H]1[C@@H](N)[C@H](n2cnc3c(=O)[nH]c(NC(=O)C(C)C)nc32)O[C@@H]1CO[Si](C)(C)C(C)(C)C

nearest known ligand 0.51

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 1/20 0.48
▸ TAS1R3 Q7RTX0 2/20 0.47
▸ TAS1R1 Q7RTX1 2/20 0.47
▸ HINT1 P49773 5/20 0.39
▸ IMPDH2 P12268 2/20 0.38
▸ IMPDH1 P20839 1/20 0.38
▸ ALDH1A1 P00352 1/20 0.38
▸ HPGD P15428 2/20 0.38
▸ MEN1 O00255 1/20 0.37
▸ KMT2A Q03164 1/20 0.37
▸ KRAS P01116 2/20 0.36

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
SCHEMBL20434944 0.92 TAS1R3 (0.53) KDM4ETAS1R3TAS1R1HINT1IMPDH2
SCHEMBL25613001 0.91 KDM4E (0.48) KDM4ETAS1R3TAS1R1HINT1IMPDH2
SCHEMBL24465163 0.88 KDM4E (0.58) KDM4ETAS1R3TAS1R1HINT1IMPDH2
SCHEMBL20154782 0.87 KDM4E (0.51) KDM4ETAS1R3TAS1R1HINT1IMPDH2
SCHEMBL22883219 0.87 TAS1R3 (0.62) KDM4ETAS1R3TAS1R1HINT1IMPDH2
SCHEMBL29664919 0.85 TAS1R3 (0.53) KDM4ETAS1R3TAS1R1HINT1IMPDH2
SCHEMBL24512507 0.85 TAS1R3 (0.53) KDM4ETAS1R3TAS1R1HINT1IMPDH2
SCHEMBL25107034 0.85 TAS1R3 (0.53) KDM4ETAS1R3TAS1R1HINT1IMPDH2
SCHEMBL29870610 0.85 TAS1R3 (0.53) KDM4ETAS1R3TAS1R1HINT1IMPDH2
SCHEMBL20655347 0.85 KDM4E (0.48) KDM4ETAS1R3TAS1R1HINT1IMPDH2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210009630-A1 CYCLIC DINUCLEOTIDES AS STING AGONISTS JANSSEN PHARMACEUTICA NV (BE) 2021-01-14 — — 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-20210009630-A1 CYCLIC DINUCLEOTIDES AS STING AGONISTS STING1, CGAS, IFNAR1 KDM4E 4282/4885TAS1R3 745/4885TAS1R1 280/4885

“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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