SCHEMBL10055440

SCHEMBL10055440

Cc1ccc(Cn2c(=O)n(CC(C)C(=O)O)c(=O)[nH]/c2=N\c2cccc(C3CCCCC3)c2)cc1

nearest known ligand 0.59

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ P2RX3 P56373 20/20 0.59

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
SCHEMBL17590605 1.00 P2RX3 (0.59) P2RX3
SCHEMBL10055252 0.99 P2RX3 (0.58) P2RX3
SCHEMBL10055309 0.92 P2RX3 (0.61) P2RX3
SCHEMBL10055241 0.91 P2RX3 (0.60) P2RX3
SCHEMBL10055363 0.90 P2RX3 (0.59) P2RX3
SCHEMBL10056960 0.89 P2RX3 (0.57) P2RX3
SCHEMBL10057315 0.86 P2RX3 (0.53) P2RX3
SCHEMBL17590739 0.85 P2RX3 (0.51) P2RX3
SCHEMBL10055323 0.85 P2RX3 (0.51) P2RX3
SCHEMBL17590504 0.84 P2RX3 (0.56) 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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