SCHEMBL20960149

SCHEMBL20960149

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

nearest known ligand 0.58

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ POLRMT O00411 1/20 0.58
▸ P2RY1 P47900 5/20 0.38
▸ P2RY2 P41231 3/20 0.38
▸ P2RY11 Q96G91 1/20 0.38
▸ P2RX1 P51575 3/20 0.38
▸ P2RX3 P56373 3/20 0.38
▸ P2RX4 Q99571 2/20 0.38
▸ P2RX2 Q9UBL9 1/20 0.33
▸ RNASEL Q05823 2/20 0.33

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
SCHEMBL20834806 0.89 POLRMT (0.59) POLRMTP2RY1P2RY2P2RY11P2RX1
SCHEMBL20834808 0.86 POLRMT (0.56) POLRMTP2RY1P2RY2P2RY11P2RX1
SCHEMBL21120428 0.86 POLRMT (0.56) POLRMTP2RY1P2RY2P2RY11P2RX1
SCHEMBL19412771 0.85 POLRMT (0.61) POLRMTP2RY1P2RY2P2RY11P2RX1
SCHEMBL25766615 0.85 POLRMT (0.42) POLRMT
SCHEMBL25770236 0.85 POLRMT (0.42) POLRMT
SCHEMBL24942272 0.84 POLRMT (0.67) POLRMTP2RY1P2RY2P2RY11P2RX1
SCHEMBL23819093 0.84 POLRMT (0.40) POLRMT
SCHEMBL25077109 0.83 POLRMT (0.41) POLRMT
SCHEMBL25771349 0.83 POLRMT (0.41) 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-3068405-B1 PYRROLO [1,2,F][1,2,4]TRIAZINES USEFUL FOR TREATING RESPIRATORY SYNCITIAL VIRUS INFECTIONS GILEAD SCIENCES INC (US) 2019-05-01 — — EP disclosed
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