SCHEMBL15833215

SCHEMBL15833215

C[C@]1(O)C(n2cnc3c(=O)[nH]c(N)nc32)O[C@](F)(CO)[C@H]1O

nearest known ligand 0.52

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ ADORA3 P0DMS8 1/20 0.52
▸ HINT1 P49773 1/20 0.44
▸ TK1 P04183 2/20 0.43
▸ HPGD P15428 1/20 0.42
▸ PNP P00491 2/20 0.42
▸ STING1 Q86WV6 2/20 0.42
▸ USP2 O75604 1/20 0.42
▸ TSHR P16473 1/20 0.42
▸ EDNRA P25101 1/20 0.42
▸ HTR2A P28223 1/20 0.42
▸ RECQL P46063 1/20 0.42
▸ BLM P54132 1/20 0.42
▸ HBB P68871 1/20 0.42
▸ HSD17B10 Q99714 1/20 0.42
▸ NT5E P21589 1/20 0.42
▸ ADORA2A P29274 1/20 0.41

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
SCHEMBL15833022 1.00 ADORA3 (0.52) ADORA3HINT1TK1HPGDPNP
SCHEMBL18877390 0.92 ADORA3 (0.52) ADORA3HINT1TK1HPGDPNP
SCHEMBL15837295 0.92 ADORA3 (0.52) ADORA3HINT1TK1HPGDPNP
SCHEMBL15833217 0.92 ADORA3 (0.52) ADORA3HINT1TK1HPGDPNP
SCHEMBL18672143 0.92 ADORA3 (0.52) ADORA3HINT1TK1HPGDPNP
SCHEMBL16644443 0.91 ADORA3 (0.48) ADORA3HINT1TK1HPGDPNP
SCHEMBL31228286 0.90 ADORA3 (0.50) ADORA3HINT1TK1HPGDPNP
SCHEMBL31228276 0.90 ADORA3 (0.53) ADORA3HINT1TK1PNPSTING1
SCHEMBL15837259 0.89 ADORA3 (0.39) ADORA3HINT1HPGDSTING1ADORA2A
SCHEMBL15833130 0.87 ADORA3 (0.48) ADORA3HINT1TK1PNPSTING1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20160016987-A1 SUBSTITUTED NUCLEOSIDES, NUCLEOTIDES AND ANALOGS THEREOF ALIOS BIOPHARMA, INC. 2016-01-21 — — US disclosed
WO-2015054465-A1 SUBSTITUTED NUCLEOSIDES, NUCLEOTIDES AND ANALOGS THEREOF ALIOS BIOPHARMA, INC. (US) 2015-04-16 — — WO disclosed
WO-2014100505-A1 SUBSTITUTED NUCLEOSIDES, NUCLEOTIDES AND ANALOGS THEREOF ALIOS BIOPHARMA, INC. (US) 2014-06-26 — — WO 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-20160016987-A1 SUBSTITUTED NUCLEOSIDES, NUCLEOTIDES AND ANALOGS THEREOF PNP, NUDT1, NT5C2 ADORA3 97/4885HINT1 83/4885TK1 50/4885

“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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