SCHEMBL24700209

SCHEMBL24700209

COP(=O)(O)OP(=O)(O)OP(=O)(O)OC[C@@H]1C[C@H](C)[C@H](c2ccc3c(N)ncnn23)O1

nearest known ligand 0.53

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ POLRMT O00411 1/20 0.48
▸ P2RY1 P47900 3/20 0.37
▸ P2RY2 P41231 3/20 0.37
▸ P2RX1 P51575 2/20 0.37
▸ P2RX3 P56373 2/20 0.37
▸ P2RX2 Q9UBL9 2/20 0.37
▸ SRC P12931 1/20 0.37
▸ P2RX4 Q99571 1/20 0.37
▸ ALDH1A1 P00352 1/20 0.37
▸ SMN1; SMN2 Q16637 1/20 0.37
▸ P2RY12 Q9H244 1/20 0.36
▸ TRPM2 O94759 2/20 0.35
▸ MACROD2 A1Z1Q3 1/20 0.35
▸ SIRT6 Q8N6T7 1/20 0.35
▸ MACROD1 Q9BQ69 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
SCHEMBL20059049 0.94 POLRMT (0.55) POLRMTP2RY1P2RY2P2RX1P2RX3
SCHEMBL23960110 0.84 POLRMT (0.57) POLRMTP2RY1P2RY2P2RX1P2RX3
SCHEMBL24699951 0.81 P2RX3 (0.41) POLRMTP2RY1P2RY2P2RX1P2RX3
SCHEMBL25915354 0.78 DOT1L (0.36) POLRMT
SCHEMBL13696066 0.78 DOT1L (0.37) POLRMTSRC
SCHEMBL20058766 0.78 DOT1L (0.37) POLRMTSRC
SCHEMBL13532219 0.78 DOT1L (0.37) POLRMTSRC
SCHEMBL23960108 0.78 POLRMT (0.47) POLRMTP2RY1P2RY2SRCSMN1; SMN2
SCHEMBL23047607 0.77 POLRMT (0.53) POLRMTP2RY1P2RX1P2RX3P2RX2
SCHEMBL24340456 0.77 POLRMT (0.53) POLRMTP2RY1P2RX1P2RX3P2RX2

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
EP-2909209-B1 2'-CYANO SUBSTITUTED NUCLEOSIDE DERIVATIVES AND METHODS OF USE THEREOF FOR TREATMENT OF VIRAL DISEASES MERCK SHARP & DOHME LLC (US) 2022-08-03 — — EP disclosed
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