SCHEMBL23425451

SCHEMBL23425451

CC1[C@@H](CO)O[C@H](n2cnc3c(=O)[nH]c(N)nc32)[C@@H](O)[C@H]1O

nearest known ligand 0.66

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ HPGD P15428 2/20 0.66
▸ HINT1 P49773 5/20 0.65
▸ NT5E P21589 1/20 0.62
▸ GSK3A P49840 2/20 0.58
▸ RPS6KA3 P51812 2/20 0.58
▸ MAPK14 Q16539 2/20 0.58
▸ TGM2 P21980 1/20 0.57
▸ CYP2C19 P33261 1/20 0.57
▸ PNP P00491 2/20 0.56
▸ PAX8 Q06710 1/20 0.56
▸ FUT5 Q11128 1/20 0.55
▸ TAAR1 Q96RJ0 1/20 0.55

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
SCHEMBL16317882 0.97 HPGD (0.64) HPGDHINT1NT5EGSK3ARPS6KA3
SCHEMBL12031280 0.97 HPGD (0.64) HPGDHINT1NT5EGSK3ARPS6KA3
SCHEMBL26208536 0.97 HPGD (0.64) HPGDHINT1NT5EGSK3ARPS6KA3
SCHEMBL1738417 0.97 HPGD (0.64) HPGDHINT1NT5EGSK3ARPS6KA3
SCHEMBL1738418 0.97 HPGD (0.64) HPGDHINT1NT5EGSK3ARPS6KA3
SCHEMBL1738416 0.97 HPGD (0.64) HPGDHINT1NT5EGSK3ARPS6KA3
Guanosine SCHEMBL24049417 0.92 HPGD (0.76) HPGDHINT1NT5EGSK3ARPS6KA3
Guanosine SCHEMBL24049608 0.92 HPGD (0.76) HPGDHINT1NT5EGSK3ARPS6KA3
Guanosine SCHEMBL20750695 0.92 HPGD (0.76) HPGDHINT1NT5EGSK3ARPS6KA3
Guanosine SCHEMBL278157 0.92 HPGD (0.76) HPGDHINT1NT5EGSK3ARPS6KA3

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-11021511-B2 Cyclic dinucleotides as sting agonists JANSSEN BIOTECH, INC. (US) 2021-06-01 — — 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-11021511-B2 Cyclic dinucleotides as sting agonists STING1, CGAS, MAVS HPGD 1596/4885HINT1 1647/4885NT5E 544/4885

“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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