SCHEMBL23734306

SCHEMBL23734306

COCO[C@@H]1C[C@H](n2cc(C#CCOCSSC(C)(C)CN)c3c(N)ncnc32)O[C@@H]1COP(=O)(O)OP(=O)(O)OP(=O)(O)O

nearest known ligand 0.39

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
P2RX3 P56373 4/20 0.36
P2RX1 P51575 2/20 0.36
P2RX2 Q9UBL9 1/20 0.36
P2RX4 Q99571 3/20 0.35
ENTPD1 P49961 1/20 0.35
RNASEL Q05823 3/20 0.34
DTYMK P23919 2/20 0.34
P2RX7 Q99572 1/20 0.34
POLB P06746 1/20 0.34

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
SCHEMBL24823140 1.00 P2RX3 (0.36) P2RX3P2RX1P2RX2P2RX4ENTPD1
SCHEMBL23734491 0.93 ENTPD1 (0.36) P2RX3P2RX1P2RX2P2RX4ENTPD1
SCHEMBL23734525 0.93 P2RX3 (0.37) P2RX3P2RX1P2RX2P2RX4ENTPD1
SCHEMBL24823762 0.93 P2RX3 (0.37) P2RX3P2RX1P2RX2P2RX4ENTPD1
SCHEMBL23734355 0.92 P2RX3 (0.35) P2RX3P2RX1P2RX2P2RX4ENTPD1
SCHEMBL23734524 0.91 POLB (0.35) P2RX3P2RX1P2RX2P2RX4ENTPD1
SCHEMBL24906065 0.91 POLB (0.34) P2RX3P2RX1P2RX4DTYMKPOLB
SCHEMBL23734288 0.88 POLG (0.40) P2RX3P2RX1P2RX4POLB
SCHEMBL24822985 0.88 FUT5 (0.38) DTYMKPOLB
SCHEMBL23734254 0.88 FUT5 (0.38) DTYMKPOLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11085076-B2 Synthesis of novel disulfide linker based nucleotides as reversible terminators for DNA sequencing by synthesis THE TRUSTEES OF COLUMBIA UNIVERSITY IN THE CITY OF NEW YORK (US) 2021-08-10 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 (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-11085076-B2 Synthesis of novel disulfide linker based nucleotides as reversible terminators for DNA sequencing by synthesis POLRMT, RNGTT, MTR P2RX3 4623/4885P2RX1 4585/4885P2RX2 4575/4885

“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.