SCHEMBL21078486

SCHEMBL21078486

C=C(C)[C@]1(O)[C@H](n2ccc3c(N)ncnc32)O[C@](F)(COP(=O)(O)OP(=O)(O)OP(=O)(O)O)[C@H]1O

nearest known ligand 0.43

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ P2RY2 P41231 4/20 0.42
▸ P2RY1 P47900 3/20 0.42
▸ P2RY11 Q96G91 1/20 0.42
▸ POLRMT O00411 1/20 0.40
▸ P2RX1 P51575 3/20 0.39
▸ P2RX3 P56373 3/20 0.39
▸ P2RX2 Q9UBL9 1/20 0.39
▸ PRMT5 O14744 5/20 0.39
▸ WDR77 Q9BQA1 5/20 0.39
▸ P2RX4 Q99571 2/20 0.38
▸ RNASEL Q05823 1/20 0.35
▸ ADK P55263 1/20 0.35
▸ P2RY4 P51582 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
SCHEMBL31228172 0.90 PRMT5 (0.45) P2RY2P2RY1P2RY11POLRMTP2RX1
SCHEMBL21078538 0.87 P2RY1 (0.55) P2RY2P2RY1P2RY11P2RX1P2RX3
SCHEMBL19397146 0.85 P2RY2 (0.41) P2RY2P2RY1P2RY11POLRMTP2RX1
SCHEMBL21078516 0.85 P2RY1 (0.42) P2RY2P2RY1P2RY11POLRMTP2RX1
SCHEMBL31228569 0.85 P2RY1 (0.42) P2RY2P2RY1P2RY11POLRMTP2RX1
SCHEMBL21078474 0.83 P2RY2 (0.49) P2RY2P2RY1P2RX1P2RX3P2RX2
SCHEMBL21078499 0.82 PRMT5 (0.44) PRMT5WDR77ADK
SCHEMBL31228119 0.80 P2RY1 (0.46) P2RY2P2RY1P2RY11POLRMTP2RX1
SCHEMBL16368367 0.80 PRMT5 (0.44) P2RY2P2RY1P2RY11POLRMTP2RX1
SCHEMBL16377074 0.80 PRMT5 (0.44) P2RY2P2RY1P2RY11POLRMTP2RX1

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-20190169221-A1 SUBSTITUTED NUCLEOSIDES, NUCLEOTIDES AND ANALOGS THEREOF Janssen Biopharma, Inc. 2019-06-06 — — 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-20190169221-A1 SUBSTITUTED NUCLEOSIDES, NUCLEOTIDES AND ANALOGS THEREOF PNP, NUDT1, NT5C3B P2RY2 190/4885P2RY1 109/4885P2RY11 118/4885

“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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