SCHEMBL16647650

SCHEMBL16647650

CCOc1nc(N)nc2c1ncn2C1O[C@](CN=[N+]=[N-])(COP(=O)(O)OP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1F

nearest known ligand 0.48

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ P2RY1 P47900 9/20 0.39
▸ P2RX1 P51575 3/20 0.39
▸ P2RX3 P56373 3/20 0.39
▸ ENPP1 P22413 2/20 0.39
▸ P2RX4 Q99571 2/20 0.39
▸ P2RY11 Q96G91 2/20 0.39
▸ P2RY6 Q15077 1/20 0.39
▸ P2RY12 Q9H244 1/20 0.38
▸ P2RY2 P41231 4/20 0.38
▸ RNASEL Q05823 3/20 0.38
▸ P2RX2 Q9UBL9 1/20 0.36
▸ GPR17 Q13304 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
SCHEMBL16373904 1.00 P2RY1 (0.39) P2RY1P2RX1P2RX3ENPP1P2RX4
SCHEMBL16368053 0.92 RNASEL (0.41) P2RY1P2RX1P2RX3ENPP1P2RX4
SCHEMBL20194538 0.90 P2RY1 (0.43) P2RY1P2RX1P2RX3ENPP1P2RX4
SCHEMBL16373936 0.86 SLC29A1 (0.37) —
SCHEMBL16374032 0.86 SLC29A1 (0.37) —
SCHEMBL20754594 0.85 HSP90B1 (0.33) —
SCHEMBL17359765 0.84 TGM2 (0.47) P2RY6P2RY2
SCHEMBL16373901 0.84 TGM2 (0.47) P2RY6P2RY2
SCHEMBL16367965 0.84 P2RX3 (0.41) P2RY1P2RX1P2RX3ENPP1P2RX4
SCHEMBL16368315 0.84 P2RX1 (0.53) P2RY1P2RX1P2RX3P2RX4P2RY11

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20160318967-A1 SUBSTITUTED NUCLEOSIDES, NUCLEOTIDES AND ANALOGS THEREOF ALIOS BIOPHARMA, INC. 2016-11-03 — — US disclosed
WO-2015054465-A1 SUBSTITUTED NUCLEOSIDES, NUCLEOTIDES AND ANALOGS THEREOF ALIOS BIOPHARMA, INC. (US) 2015-04-16 — — 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-20160318967-A1 SUBSTITUTED NUCLEOSIDES, NUCLEOTIDES AND ANALOGS THEREOF PNP, NT5C3B, NT5C2 P2RY1 68/4885P2RX1 77/4885P2RX3 104/4885

“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.

Send feedback