SCHEMBL14642635

SCHEMBL14642635

C[C@H]1C[C@@H](CO)O[C@H]1c1cc(-c2ncco2)c2c(N)ncnn12

nearest known ligand 0.42

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ PIK3CD O00329 5/20 0.42
▸ ACVRL1 P37023 14/20 0.39
▸ DOT1L Q8TEK3 1/20 0.36

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
SCHEMBL14642596 0.89 PIK3CD (0.41) PIK3CDACVRL1DOT1L
SCHEMBL13519773 0.81 ACVRL1 (0.42) PIK3CDACVRL1
SCHEMBL10101592 0.81 DOT1L (0.44) PIK3CDACVRL1DOT1L
SCHEMBL14642597 0.81 PIK3CD (0.38) PIK3CDACVRL1
SCHEMBL14642543 0.81 ACVRL1 (0.37) PIK3CDACVRL1
SCHEMBL14642542 0.81 CSNK2A2 (0.36) PIK3CDACVRL1
SCHEMBL10101526 0.80 PIK3CD (0.40) PIK3CDACVRL1DOT1L
SCHEMBL10101590 0.80 PIK3CD (0.40) PIK3CDACVRL1DOT1L
SCHEMBL14642738 0.80 ACVRL1 (0.41) PIK3CDACVRL1
SCHEMBL14642529 0.79 PIK3CD (0.37) PIK3CDACVRL1

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-20130018013-A1 BICYCLIC NUCLEOSIDES AND NUCLEOTIDES AS THERAPEUTIC AGENTS BIOTA SCIENTIFIC MANAGEMENT PTY LTD (AU) 2013-01-17 — — 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-20130018013-A1 BICYCLIC NUCLEOSIDES AND NUCLEOTIDES AS THERAPEUTIC AGENTS NTPCR, PNP, DCTD PIK3CD 636/4885ACVRL1 4215/4885DOT1L 3212/4885

“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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