SCHEMBL16639951

SCHEMBL16639951

Cc1nc2c(ncn2[C@@H]2O[C@](F)(COP(=O)(O)OP(=O)(O)OP(=O)(O)O)[C@@H](F)[C@@]2(C)O)c(=O)[nH]1

nearest known ligand 0.41

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ POLG P54098 2/20 0.41
▸ PNP P00491 1/20 0.40
▸ P2RY2 P41231 3/20 0.37
▸ P2RY4 P51582 1/20 0.37
▸ IMPDH2 P12268 4/20 0.37
▸ IMPDH1 P20839 2/20 0.37
▸ ADORA3 P0DMS8 1/20 0.37
▸ P2RY1 P47900 5/20 0.37
▸ POLB P06746 2/20 0.36
▸ P2RX1 P51575 1/20 0.36
▸ P2RX3 P56373 1/20 0.36
▸ P2RX4 Q99571 1/20 0.36
▸ TAS1R3 Q7RTX0 1/20 0.36
▸ TAS1R1 Q7RTX1 1/20 0.36
▸ TGM2 P21980 1/20 0.36
▸ FUT5 Q11128 1/20 0.35
▸ POLA1 P09884 1/20 0.35

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
SCHEMBL15837297 0.93 POLG (0.42) POLGPNPP2RY2P2RY4IMPDH2
SCHEMBL16368330 0.91 POLG (0.50) POLGPNPP2RY2P2RY4P2RY1
SCHEMBL18672097 0.91 POLG (0.50) POLGPNPP2RY2P2RY4P2RY1
SCHEMBL16367976 0.90 POLG (0.40) POLGPNPP2RY2IMPDH2IMPDH1
SCHEMBL17357551 0.90 POLG (0.40) POLGPNPP2RY2IMPDH2IMPDH1
SCHEMBL15837321 0.88 POLG (0.42) POLGPNPP2RY2IMPDH2IMPDH1
SCHEMBL16367966 0.85 POLG (0.41) POLGPNPP2RY2P2RY4IMPDH2
SCHEMBL15837276 0.84 POLG (0.39) POLGPNPP2RY2IMPDH2IMPDH1
SCHEMBL15833114 0.84 POLG (0.51) POLGPNPP2RY2P2RY4ADORA3
SCHEMBL22474912 0.84 POLG (0.51) POLGPNPP2RY2P2RY4P2RY1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20180044369-A1 SUBSTITUTED NUCLEOSIDES, NUCLEOTIDES AND ANALOGS THEREOF Janssen Biopharma, Inc. 2018-02-15 — — US disclosed
US-9862743-B2 Substituted nucleosides, nucleotides and analogs thereof ALIOS BIOPHARMA, INC. (US) 2018-01-09 — — US disclosed
US-20170143749-A1 SUBSTITUTED NUCLEOSIDES, NUCLEOTIDES AND ANALOGS THEREOF Janssen Biopharma, Inc. 2017-05-25 — — US disclosed
US-20170143751-A1 SUBSTITUTED NUCLEOSIDES, NUCLEOTIDES AND ANALOGS THEREOF Janssen Pharmaceuticals, Inc. 2017-05-25 — — US disclosed
US-9603863-B2 Substituted nucleosides, nucleotides and analogs thereof ALIOS BIOPHARMA, INC. (US) 2017-03-28 — — US disclosed
US-20150366887-A1 SUBSTITUTED NUCLEOSIDES, NUCLEOTIDES AND ANALOGS THEREOF Janssen Pharmaceuticals, Inc. 2015-12-24 — — US disclosed
US-20150366888-A1 SUBSTITUTED NUCLEOSIDES, NUCLEOTIDES AND ANALOGS THEREOF Janssen Pharmaceuticals, Inc. 2015-12-24 — — US disclosed
US-20150105341-A1 SUBSTITUTED NUCLEOSIDES, NUCLEOTIDES AND ANALOGS THEREOF Janssen Pharmaceuticals, Inc. 2015-04-16 — — 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-20150366888-A1 SUBSTITUTED NUCLEOSIDES, NUCLEOTIDES AND ANALOGS THEREOF PNP, NT5C3B, TYMP POLG 956/4885PNP 1/4885P2RY2 451/4885
US-20180044369-A1 SUBSTITUTED NUCLEOSIDES, NUCLEOTIDES AND ANALOGS THEREOF PNP, NT5C3B, NUDT1 POLG 582/4885PNP 1/4885P2RY2 154/4885
US-20170143749-A1 SUBSTITUTED NUCLEOSIDES, NUCLEOTIDES AND ANALOGS THEREOF PNP, NT5C3B, TYMP POLG 956/4885PNP 1/4885P2RY2 451/4885
US-20170143751-A1 SUBSTITUTED NUCLEOSIDES, NUCLEOTIDES AND ANALOGS THEREOF PNP, NUDT1, NT5C3B POLG 506/4885PNP 1/4885P2RY2 250/4885
US-20150105341-A1 SUBSTITUTED NUCLEOSIDES, NUCLEOTIDES AND ANALOGS THEREOF PNP, NT5C3B, NUDT1 POLG 582/4885PNP 1/4885P2RY2 154/4885
US-20150366887-A1 SUBSTITUTED NUCLEOSIDES, NUCLEOTIDES AND ANALOGS THEREOF PNP, NUDT1, NT5C3B POLG 506/4885PNP 1/4885P2RY2 250/4885

“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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