SCHEMBL16644560

SCHEMBL16644560

C[C@]1(Cl)C(n2ccc(N)nc2=O)O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)[C@H]1O

nearest known ligand 0.57

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ POLG P54098 1/20 0.57
▸ P2RY2 P41231 12/20 0.55
▸ P2RY4 P51582 7/20 0.55
▸ POLA1 P09884 2/20 0.55
▸ POLB P06746 1/20 0.51
▸ P2RY6 Q15077 7/20 0.50

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
SCHEMBL16368334 1.00 POLG (0.57) POLGP2RY2P2RY4POLA1POLB
SCHEMBL16665344 0.91 POLG (0.59) POLGP2RY2P2RY4POLA1POLB
SCHEMBL16777792 0.91 POLG (0.59) POLGP2RY2P2RY4POLA1POLB
2'-C-Methylcytidine Triphosphate SCHEMBL19537067 0.90 P2RY2 (0.68) POLGP2RY2P2RY4POLA1POLB
2'-C-Methylcytidine Triphosphate SCHEMBL21006164 0.90 P2RY2 (0.68) POLGP2RY2P2RY4POLA1POLB
SCHEMBL13468595 0.90 POLG (0.58) POLGP2RY2P2RY4POLA1POLB
2'-C-Methylcytidine Triphosphate SCHEMBL19537440 0.90 P2RY2 (0.68) POLGP2RY2P2RY4POLA1POLB
2'-C-Methylcytidine Triphosphate SCHEMBL21007902 0.90 P2RY2 (0.68) POLGP2RY2P2RY4POLA1POLB
2'-C-Methylcytidine Triphosphate SCHEMBL18561539 0.90 P2RY2 (0.68) POLGP2RY2P2RY4POLA1POLB
2'-C-Methylcytidine Triphosphate SCHEMBL14853857 0.90 P2RY2 (0.68) POLGP2RY2P2RY4POLA1POLB

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-20150366888-A1 SUBSTITUTED NUCLEOSIDES, NUCLEOTIDES AND ANALOGS THEREOF Janssen Pharmaceuticals, Inc. 2015-12-24 — — US disclosed
US-20150366887-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 (3 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 956/4885P2RY2 451/4885P2RY4 148/4885
US-20150105341-A1 SUBSTITUTED NUCLEOSIDES, NUCLEOTIDES AND ANALOGS THEREOF PNP, NT5C3B, NUDT1 POLG 582/4885P2RY2 154/4885P2RY4 101/4885
US-20150366887-A1 SUBSTITUTED NUCLEOSIDES, NUCLEOTIDES AND ANALOGS THEREOF PNP, NUDT1, NT5C3B POLG 506/4885P2RY2 250/4885P2RY4 129/4885

“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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