SCHEMBL10055955

SCHEMBL10055955

C[C@@H](Cn1c(=O)[nH]/c(=N\c2ccc3ncccc3c2)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
SCHEMBL19183861 0.91 P2RX3 (0.62) P2RX3
SCHEMBL10056041 0.90 P2RX3 (0.49) P2RX3
SCHEMBL10056300 0.89 P2RX3 (0.60) P2RX3
SCHEMBL17590974 0.86 P2RX3 (0.61) P2RX3
SCHEMBL10056098 0.86 P2RX3 (0.58) P2RX3
SCHEMBL10056000 0.85 P2RX3 (0.49) P2RX3
SCHEMBL10055351 0.83 P2RX3 (0.59) P2RX3
SCHEMBL10055925 0.83 P2RX3 (0.60) P2RX3
SCHEMBL17701769 0.83 P2RX3 (0.61) P2RX3
SCHEMBL10057101 0.82 P2RX3 (0.60) 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 4 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
EP-2604595-B1 TRIAZINE DERIVATIVE AND PHARMACEUTICAL COMPOUND THAT CONTAINS SAME AND EXHIBITS ANALGESIC ACTIVITY SHIONOGI & CO (JP) 2016-03-16 — — EP disclosed
WO-2012020749-A1 TRIAZINE DERIVATIVE AND PHARMACEUTICAL COMPOUND THAT CONTAINS SAME AND EXHIBITS ANALGESIC ACTIVITY 塩野義製薬株式会社 (JP) 2012-02-16 — — WO disclosed
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