SCHEMBL19183992

SCHEMBL19183992

CCOc1ccc(/N=c2\[nH]c(=O)n(C[C@H](C)C(=O)OC)c(=O)n2Cc2ccc(C)cc2)cc1OC

nearest known ligand 0.62

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ P2RX3 P56373 20/20 0.62

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
SCHEMBL10056989 0.92 P2RX3 (0.54) P2RX3
SCHEMBL10055289 0.92 P2RX3 (0.60) P2RX3
SCHEMBL10055521 0.92 P2RX3 (0.60) P2RX3
SCHEMBL10057244 0.92 P2RX3 (0.62) P2RX3
SCHEMBL17590335 0.91 P2RX3 (0.60) P2RX3
SCHEMBL10057253 0.91 P2RX3 (0.60) P2RX3
SCHEMBL10057006 0.89 P2RX3 (0.62) P2RX3
SCHEMBL17590523 0.89 P2RX3 (0.61) P2RX3
SCHEMBL10057191 0.88 P2RX3 (0.61) P2RX3
SCHEMBL10057001 0.88 P2RX3 (0.62) 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 2 patents. 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
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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