SCHEMBL10101488

SCHEMBL10101488

C[C@@H]1[C@@H](CO)O[C@@H](c2cc(I)c3c(N)ncnn23)[C@]1(C)F

nearest known ligand 0.34

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ ACVRL1 P37023 13/20 0.34
▸ PIK3CD O00329 3/20 0.33
▸ ADORA2A P29274 1/20 0.31
▸ PI4KA P42356 1/20 0.31
▸ PI4K2B Q8TCG2 1/20 0.31
▸ PI4K2A Q9BTU6 1/20 0.31
▸ PI4KB Q9UBF8 1/20 0.31

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
SCHEMBL10101487 0.90 ACVRL1 (0.35) ACVRL1PIK3CDADORA2API4KAPI4K2B
SCHEMBL10101498 0.89 ACVRL1 (0.37) ACVRL1PIK3CD
SCHEMBL10101501 0.88 PIK3CD (0.38) ACVRL1PIK3CD
SCHEMBL10101517 0.85 CSNK2A2 (0.33) ACVRL1PIK3CD
SCHEMBL10101522 0.85 ACVRL1 (0.32) ACVRL1ADORA2A
SCHEMBL10101509 0.85 PIK3CD (0.36) ACVRL1PIK3CD
SCHEMBL10101521 0.85 NPC1 (0.35) ACVRL1PIK3CDADORA2A
SCHEMBL10101547 0.85 ADK (0.35) ACVRL1PIK3CDADORA2A
SCHEMBL10101492 0.84 ACVRL1 (0.34) ACVRL1PIK3CDADORA2API4KAPI4K2B
SCHEMBL10101542 0.84 ACVRL1 (0.32) 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 ACVRL1 4215/4885PIK3CD 636/4885ADORA2A 69/4885

“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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