SCHEMBL19185115

SCHEMBL19185115

CC1(Cn2c(=O)nc(Nc3ccc(O)c(F)c3)n(Cc3ccc(Cl)cc3)c2=O)COC(C)(C)OC1

nearest known ligand 0.69

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ P2RX3 P56373 20/20 0.69

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
SCHEMBL15081110 0.91 P2RX3 (0.73) P2RX3
SCHEMBL9982821 0.87 P2RX3 (0.74) P2RX3
SCHEMBL15081655 0.85 P2RX3 (0.70) P2RX3
SCHEMBL10055410 0.81 P2RX3 (0.70) P2RX3
SCHEMBL10057073 0.73 P2RX3 (1.00) P2RX3
SCHEMBL12046801 0.73 P2RX3 (1.00) P2RX3
SCHEMBL12045886 0.72 P2RX3 (0.61) P2RX3
SCHEMBL17590253 0.72 P2RX3 (0.69) P2RX3
SCHEMBL10057047 0.70 P2RX3 (1.00) P2RX3
SCHEMBL12046713 0.70 P2RX3 (0.80) P2RX3

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-9718790-B2 Triazine derivative and pharmaceutical composition having an analgesic activity comprising the same SHIONOGI & CO., LTD. (JP) 2017-08-01 — — US disclosed
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