SCHEMBL10101544

SCHEMBL10101544

C#Cc1cc([C@@H]2O[C@H](CO)[C@@H](F)C2(C)C)n2ncnc(N)c12

nearest known ligand 0.35

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ ADK P55263 1/20 0.35
▸ DOT1L Q8TEK3 1/20 0.35
▸ ACVRL1 P37023 12/20 0.33
▸ ADORA2A P29274 1/20 0.31
▸ PIK3CD O00329 2/20 0.30

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
SCHEMBL10101546 0.89 ADK (0.36) ADKDOT1LACVRL1ADORA2APIK3CD
SCHEMBL10101543 0.89 ACVRL1 (0.32) ACVRL1
SCHEMBL10101500 0.86 ACVRL1 (0.38) ACVRL1PIK3CD
SCHEMBL10101547 0.85 ADK (0.35) ADKDOT1LACVRL1ADORA2APIK3CD
SCHEMBL644948 0.85 ADORA2A (0.41) ADKDOT1LACVRL1ADORA2APIK3CD
SCHEMBL10101505 0.85 PIK3CD (0.37) ACVRL1PIK3CD
SCHEMBL10101492 0.85 ACVRL1 (0.34) ACVRL1ADORA2APIK3CD
SCHEMBL10101518 0.82 NPC1 (0.35) ACVRL1ADORA2A
SCHEMBL10101515 0.82 ACVRL1 (0.33) ACVRL1PIK3CD
SCHEMBL10101511 0.82 PIK3CD (0.35) ACVRL1PIK3CD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8119607-B2 Bicyclic nucleosides and nucleotides as therapeutic agents BIOTA SCIENTIFIC MANAGEMENT PTY LTD (AU) 2012-02-21 — — US disclosed
US-20100035836-A1 BICYCLIC NUCLEOSIDES AND NUCLEOTIDES AS THERAPEUTIC AGENTS BIOTA SCIENTIFIC MANAGEMENT (AU) 2010-02-11 — — 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-20100035836-A1 BICYCLIC NUCLEOSIDES AND NUCLEOTIDES AS THERAPEUTIC AGENTS NTPCR, PNP, DCTD ADK 72/4885DOT1L 3212/4885ACVRL1 4215/4885

“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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