SCHEMBL10055410

SCHEMBL10055410

O=c1nc(Nc2ccc(O)c(F)c2)n(Cc2ccc(Cl)cc2)c(=O)n1Cc1ccccc1

nearest known ligand 0.70

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ P2RX3 P56373 20/20 0.70

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
SCHEMBL12046703 0.83 P2RX3 (1.00) P2RX3
SCHEMBL10057073 0.81 P2RX3 (1.00) P2RX3
SCHEMBL17590253 0.81 P2RX3 (0.69) P2RX3
SCHEMBL19185115 0.81 P2RX3 (0.69) P2RX3
SCHEMBL12045975 0.80 P2RX3 (0.80) P2RX3
SCHEMBL12045961 0.80 P2RX3 (0.80) P2RX3
SCHEMBL12046732 0.77 P2RX3 (1.00) P2RX3
SCHEMBL10055121 0.76 P2RX3 (0.82) P2RX3
SCHEMBL12045977 0.76 P2RX3 (0.85) P2RX3
SCHEMBL12046713 0.76 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
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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