SCHEMBL19184142

SCHEMBL19184142

C[C@@H](Cn1c(=O)[nH]/c(=N\c2ccc(OC(F)F)c(F)c2)n(Cc2ccc(Cl)cc2)c1=O)C(=O)O

nearest known ligand 0.60

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ P2RX3 P56373 20/20 0.60

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
SCHEMBL12047196 0.95 P2RX3 (0.59) P2RX3
SCHEMBL12047195 0.95 P2RX3 (0.59) P2RX3
SCHEMBL19232006 0.92 P2RX3 (0.61) P2RX3
SCHEMBL17701784 0.92 P2RX3 (0.61) P2RX3
SCHEMBL10057123 0.92 P2RX3 (0.62) P2RX3
SCHEMBL10055417 0.92 P2RX3 (0.58) P2RX3
SCHEMBL10055198 0.89 P2RX3 (0.58) P2RX3
SCHEMBL17701766 0.89 P2RX3 (0.62) P2RX3
SCHEMBL17701839 0.88 P2RX3 (0.62) P2RX3
SCHEMBL10055493 0.88 P2RX3 (0.59) 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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