SCHEMBL19184002

SCHEMBL19184002

Cc1ccc2cc(/N=c3\[nH]c(=O)n([C@@H](C)[C@@H](C)C(=O)O)c(=O)n3Cc3ccc(Cl)cc3)ccc2n1

nearest known ligand 0.61

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ P2RX3 P56373 20/20 0.61

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
SCHEMBL17590720 0.94 P2RX3 (0.61) P2RX3
SCHEMBL17590575 0.92 P2RX3 (0.54) P2RX3
SCHEMBL19184284 0.91 P2RX3 (0.51) P2RX3
SCHEMBL10057063 0.91 P2RX3 (0.62) P2RX3
SCHEMBL10056059 0.91 P2RX3 (0.64) P2RX3
SCHEMBL19183877 0.90 P2RX3 (0.63) P2RX3
SCHEMBL17590974 0.89 P2RX3 (0.61) P2RX3
SCHEMBL10055932 0.88 P2RX3 (0.49) P2RX3
SCHEMBL19184357 0.88 P2RX3 (0.63) P2RX3
SCHEMBL17590764 0.88 P2RX3 (0.63) 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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