SCHEMBL15070351

SCHEMBL15070351

CC[C@]1(COP(=O)(O)OP(=O)(O)OP(=O)(O)O)O[C@@H](n2cnc3c(N)ccnc32)[C@H](F)[C@@H]1O

nearest known ligand 0.57

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ P2RX3 P56373 6/20 0.43
▸ P2RX1 P51575 5/20 0.43
▸ P2RX4 Q99571 4/20 0.43
▸ P2RX2 Q9UBL9 3/20 0.42
▸ ADORA2A P29274 1/20 0.42
▸ ADORA2B P29275 1/20 0.42
▸ P2RY1 P47900 6/20 0.42
▸ P2RY2 P41231 4/20 0.42
▸ P2RY11 Q96G91 2/20 0.42
▸ ENPP1 P22413 1/20 0.41
▸ P2RY6 Q15077 1/20 0.41
▸ RNASEL Q05823 1/20 0.40
▸ SRC P12931 1/20 0.40
▸ ALDH1A1 P00352 1/20 0.40
▸ SMN1; SMN2 Q16637 1/20 0.40

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
SCHEMBL16367992 0.92 P2RX3 (0.45) P2RX3P2RX1P2RX4P2RX2P2RY1
SCHEMBL15070357 0.92 P2RX3 (0.43) P2RX3P2RX1P2RX4P2RX2P2RY1
SCHEMBL15070345 0.92 P2RX3 (0.42) P2RX3P2RX1P2RX4P2RX2P2RY1
SCHEMBL16367965 0.89 P2RX3 (0.41) P2RX3P2RX1P2RX4P2RX2P2RY1
SCHEMBL15070750 0.87 P2RX1 (0.57) P2RX3P2RX1P2RX4P2RX2P2RY1
SCHEMBL16490101 0.87 P2RX1 (0.57) P2RX3P2RX1P2RX4P2RX2P2RY1
SCHEMBL15070573 0.83 POLG (0.50) P2RY2P2RY6
SCHEMBL15828312 0.81 P2RX3 (0.47) P2RX3P2RX1P2RX4P2RX2ADORA2A
SCHEMBL15828284 0.81 P2RX3 (0.47) P2RX3P2RX1P2RX4P2RX2ADORA2A
SCHEMBL15070300 0.81 ADORA2A (0.48) ADORA2AADORA2BSMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20180079774-A1 SUBSTITUTED NUCLEOSIDES, NUCLEOTIDES AND ANALOGS THEREOF ALIOS BIOPHARMA, INC. 2018-03-22 — — US disclosed
US-9815864-B2 Substituted nucleosides, nucleotides and analogs thereof ALIOS BIOPHARMA, INC. (US) 2017-11-14 — — US disclosed
US-20160331770-A1 SUBSTITUTED NUCLEOSIDES, NUCLEOTIDES AND ANALOGS THEREOF Janssen Biopharma, Inc. 2016-11-17 — — US disclosed
US-9441007-B2 Substituted nucleosides, nucleotides and analogs thereof ALIOS BIOPHARMA, INC. (US) 2016-09-13 — — US disclosed
US-20150315228-A1 SUBSTITUTED NUCLEOSIDES, NUCLEOTIDES AND ANALOGS THEREOF ALIOS BIOPHARMA, INC. 2015-11-05 — — US disclosed
US-9073960-B2 Substituted nucleosides, nucleotides and analogs thereof ALIOS BIOPHARMA, INC. (US) 2015-07-07 — — US disclosed
US-20150051167-A1 SUBSTITUTED NUCLEOSIDES, NUCLEOTIDES AND ANALOGS THEREOF Janssen Biopharma, Inc. 2015-02-19 — — US disclosed
US-20150011497-A1 SUBSTITUTED NUCLEOSIDES, NUCLEOTIDES AND ANALOGS THEREOF Janssen Pharmaceuticals, Inc. 2015-01-08 — — US disclosed
US-20130165400-A1 SUBSTITUTED NUCLEOSIDES, NUCLEOTIDES AND ANALOGS THEREOF ALIOS BIOPHARMA, INC. (US) 2013-06-27 — — 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 (6 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-20130165400-A1 SUBSTITUTED NUCLEOSIDES, NUCLEOTIDES AND ANALOGS THEREOF PNP, NT5C3B, ADAR P2RX3 61/4885P2RX1 37/4885P2RX4 35/4885
US-20180079774-A1 SUBSTITUTED NUCLEOSIDES, NUCLEOTIDES AND ANALOGS THEREOF PNP, NUDT1, NT5C3B P2RX3 90/4885P2RX1 79/4885P2RX4 75/4885
US-20160331770-A1 SUBSTITUTED NUCLEOSIDES, NUCLEOTIDES AND ANALOGS THEREOF PNP, NT5C3B, ADAR P2RX3 61/4885P2RX1 37/4885P2RX4 35/4885
US-20150051167-A1 SUBSTITUTED NUCLEOSIDES, NUCLEOTIDES AND ANALOGS THEREOF PNP, NT5C3B, ADAR P2RX3 61/4885P2RX1 37/4885P2RX4 35/4885
US-20150315228-A1 SUBSTITUTED NUCLEOSIDES, NUCLEOTIDES AND ANALOGS THEREOF PNP, NT5C3B, ADAR P2RX3 61/4885P2RX1 37/4885P2RX4 35/4885
US-20150011497-A1 SUBSTITUTED NUCLEOSIDES, NUCLEOTIDES AND ANALOGS THEREOF PNP, NUDT1, NT5C3B P2RX3 90/4885P2RX1 79/4885P2RX4 75/4885

“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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