SCHEMBL19644577

SCHEMBL19644577

N#C[C@]12O[C@@H](c3csc4c(N)ncnc34)[C@H](F)[C@@]1(O)C2OP(=O)(O)OP(=O)(O)OP(=O)(O)O

nearest known ligand 0.35

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ RNASEL Q05823 2/20 0.31
▸ P2RX1 P51575 1/20 0.31
▸ P2RX3 P56373 1/20 0.31
▸ P2RX4 Q99571 1/20 0.31
▸ IMPDH2 P12268 1/20 0.30

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
SCHEMBL19644595 0.92 RNASEL (0.33) RNASELP2RX1P2RX3P2RX4
SCHEMBL19644600 0.84 POLRMT (0.36) RNASELP2RX1P2RX3P2RX4
SCHEMBL19779073 0.76 POLRMT (0.50) RNASEL
SCHEMBL17453495 0.76 P2RY2 (0.38) RNASELP2RX1P2RX3P2RX4IMPDH2
SCHEMBL17453498 0.74 P2RY2 (0.41) RNASELP2RX1P2RX3IMPDH2
SCHEMBL19644566 0.74 POLRMT (0.36) RNASELP2RX1P2RX3P2RX4
SCHEMBL19644575 0.73 HIF1A (0.32) —
SCHEMBL19644602 0.72 P2RY1 (0.40) RNASELP2RX1P2RX3P2RX4IMPDH2
SCHEMBL21880479 0.71 POLRMT (0.35) RNASELP2RX1P2RX3P2RX4
SCHEMBL19962266 0.70 P2RY2 (0.39) RNASELP2RX1P2RX3P2RX4

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-9828388-B2 Thieno[3,2-d]pyrimidine, furo[3,2-d]pyrimidine, and pyrrolo[3,2-D]pyrimidines useful for treating respiratory syncitial virus infections GILEAD SCIENCES, INC. (US) 2017-11-28 — — US disclosed
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