SCHEMBL23047623

SCHEMBL23047623

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

nearest known ligand 0.62

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ POLRMT O00411 1/20 0.50
▸ P2RX1 P51575 3/20 0.41
▸ P2RX3 P56373 3/20 0.41
▸ P2RX4 Q99571 2/20 0.41
▸ P2RX2 Q9UBL9 1/20 0.38
▸ ENTPD1 P49961 2/20 0.37
▸ P2RY2 P41231 2/20 0.36
▸ P2RY1 P47900 2/20 0.36
▸ P2RY11 Q96G91 1/20 0.36

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
SCHEMBL4967938 0.91 POLRMT (0.48) POLRMTP2RX1P2RX3P2RX4P2RX2
SCHEMBL24074599 0.86 POLRMT (0.49) POLRMTP2RX1P2RX3P2RX4P2RX2
SCHEMBL10120887 0.85 POLRMT (0.53) POLRMTP2RX1P2RX3P2RX4P2RX2
SCHEMBL10143054 0.83 POLRMT (0.49) POLRMTP2RX1P2RX3P2RX4P2RX2
SCHEMBL22355496 0.83 POLRMT (0.46) POLRMTP2RX1P2RX3P2RX4P2RX2
SCHEMBL15998230 0.83 POLRMT (0.50) POLRMTP2RX1P2RX3P2RX4P2RX2
SCHEMBL4765352 0.83 POLRMT (0.53) POLRMTP2RX1P2RX3P2RX4P2RX2
SCHEMBL23047655 0.82 POLRMT (0.49) POLRMTP2RX1P2RX3P2RX4P2RX2
SCHEMBL24790489 0.80 RIPK1 (0.33) POLRMT
SCHEMBL18666916 0.80 POLRMT (0.32) POLRMT

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-3785717-A1 METHODS FOR TREATING CORONAVIRIDAE INFECTIONS Gilead Sciences, Inc. (US) 2021-03-03 — — EP disclosed
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