SCHEMBL12729571

SCHEMBL12729571

CC(CSSc1ccccn1)OC(=O)Nc1ncnc2c1ncn2C1CC2O[Si](C(C)C)(C(C)C)O[Si](C(C)C)(C(C)C)OCC2O1

nearest known ligand 0.36

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ ADORA3 P0DMS8 1/20 0.33
▸ ADORA2A P29274 4/20 0.33
▸ ADORA2B P29275 4/20 0.33
▸ P2RY12 Q9H244 1/20 0.32

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
SCHEMBL12729601 0.86 KDM4E (0.39) —
SCHEMBL9565119 0.82 ADORA3 (0.38) ADORA3ADORA2AADORA2BP2RY12
SCHEMBL12729570 0.81 SLC29A1 (0.47) —
SCHEMBL17834988 0.81 SLC29A1 (0.47) —
SCHEMBL22983976 0.79 ADORA3 (0.40) ADORA3ADORA2AADORA2B
SCHEMBL29674405 0.79 ADORA3 (0.40) ADORA3ADORA2AADORA2B
SCHEMBL9237960 0.79 ADORA2A (0.42) ADORA3ADORA2AADORA2B
SCHEMBL12729616 0.78 HDAC1 (0.32) —
SCHEMBL12729574 0.76 P2RY12 (0.50) P2RY12
SCHEMBL12531469 0.72 POLB (0.34) —

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20160168636-A1 NUCLEOTIDE ANALOGS HELICOS BIOSCIENCES CORPORATION 2016-06-16 — — US disclosed
US-20160168636-A1 NUCLEOTIDE ANALOGS HELICOS BIOSCIENCES CORPORATION 2016-06-16 — — US disclosed
US-9163053-B2 Nucleotide analogs FLUIDIGM CORPORATION (US) 2015-10-20 — — US disclosed
US-9163053-B2 Nucleotide analogs FLUIDIGM CORPORATION (US) 2015-10-20 — — US disclosed
US-20110081647-A1 NUCLEOTIDE ANALOGS HELICOS BIOSCIENCES CORPORATION (US) 2011-04-07 — — 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-20110081647-A1 NUCLEOTIDE ANALOGS DUT, NT5C2, NUDT21 ADORA3 178/4885ADORA2A 114/4885ADORA2B 243/4885

“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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