SCHEMBL22644423

SCHEMBL22644423

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

nearest known ligand 0.55

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ HINT1 P49773 4/20 0.55
▸ ADORA3 P0DMS8 1/20 0.54
▸ STING1 Q86WV6 3/20 0.52
▸ PDE3B Q13370 1/20 0.52
▸ PDE3A Q14432 1/20 0.52
▸ NT5E P21589 1/20 0.50
▸ TAAR1 Q96RJ0 1/20 0.49
▸ GSK3A P49840 2/20 0.47
▸ RPS6KA3 P51812 2/20 0.47
▸ MAPK14 Q16539 2/20 0.47
▸ TGM2 P21980 1/20 0.47

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
SCHEMBL14853765 0.92 ADORA3 (0.59) HINT1ADORA3STING1PDE3BPDE3A
SCHEMBL3437126 0.92 ADORA3 (0.59) HINT1ADORA3STING1PDE3BPDE3A
SCHEMBL3437123 0.92 ADORA3 (0.59) HINT1ADORA3STING1PDE3BPDE3A
SCHEMBL17471689 0.92 ADORA3 (0.59) HINT1ADORA3STING1PDE3BPDE3A
SCHEMBL14946268 0.92 ADORA3 (0.59) HINT1ADORA3STING1PDE3BPDE3A
SCHEMBL22474911 0.90 ADORA3 (0.55) HINT1ADORA3STING1PDE3BPDE3A
SCHEMBL17193423 0.85 ADORA3 (0.55) HINT1ADORA3STING1PDE3BPDE3A
SCHEMBL15305496 0.85 ADORA3 (0.48) HINT1ADORA3STING1PDE3BPDE3A
SCHEMBL14948887 0.85 ADORA3 (0.56) HINT1ADORA3STING1PDE3BPDE3A
SCHEMBL18490509 0.83 ADORA3 (0.57) HINT1ADORA3STING1PDE3BPDE3A

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-20200354423-A1 MODIFIED POLYNUCLEOTIDES FOR THE PRODUCTION OF SECRETED PROTEINS MODERNA THERAPEUTICS, INC. 2020-11-12 — — 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-20200354423-A1 MODIFIED POLYNUCLEOTIDES FOR THE PRODUCTION OF SECRETED PROTEINS MSH2, POLRMT, SARNP HINT1 2487/4885ADORA3 2978/4885STING1 20/4885

“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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