SCHEMBL14946309

SCHEMBL14946309

CC[C@@]12COC([C@H](n3cnc4c(=O)[nH]c(N)nc43)O1)[C@H]2C

nearest known ligand 0.47

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ HINT1 P49773 3/20 0.45
▸ STING1 Q86WV6 8/20 0.44
▸ PDE3B Q13370 1/20 0.44
▸ PDE3A Q14432 1/20 0.44
▸ ADORA3 P0DMS8 1/20 0.44
▸ HPGD P15428 1/20 0.43

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
SCHEMBL14929368 1.00 HINT1 (0.45) HINT1STING1PDE3BPDE3AADORA3
SCHEMBL14929253 0.91 ADORA3 (0.50) HINT1STING1PDE3BPDE3AADORA3
SCHEMBL14946321 0.91 ADORA3 (0.50) HINT1STING1PDE3BPDE3AADORA3
SCHEMBL14512779 0.88 HPGD (0.46) HINT1STING1PDE3BPDE3AADORA3
SCHEMBL14537780 0.88 HPGD (0.46) HINT1STING1PDE3BPDE3AADORA3
SCHEMBL9961288 0.85 STING1 (0.44) STING1ADORA3
SCHEMBL24703672 0.83 ADORA3 (0.54) HINT1STING1PDE3BPDE3AADORA3
SCHEMBL14946338 0.83 ADORA3 (0.54) HINT1STING1PDE3BPDE3AADORA3
SCHEMBL3033632 0.83 ADORA3 (0.54) HINT1STING1PDE3BPDE3AADORA3
SCHEMBL27040 0.83 ADORA3 (0.54) HINT1STING1PDE3BPDE3AADORA3

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-20130123481-A1 MODIFIED NUCLEOSIDES, NUCLEOTIDES, AND NUCLEIC ACIDS, AND USES THEREOF modeRNA Therapeutics (US) 2013-05-16 — — 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-20130123481-A1 MODIFIED NUCLEOSIDES, NUCLEOTIDES, AND NUCLEIC ACIDS, AND USES THEREOF ADAR, NT5C3B, NSUN2 HINT1 121/4885STING1 413/4885PDE3B 1382/4885

“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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