SCHEMBL17590760

SCHEMBL17590760

Cc1ccc(Cn2c(=O)n(CC3(C(=O)O)COC3)c(=O)[nH]/c2=N\c2ccc(OC(C)C)c(Cl)c2)cc1

nearest known ligand 0.61

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ P2RX3 P56373 20/20 0.61
▸ P2RX2 Q9UBL9 1/20 0.43

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
SCHEMBL15015861 0.95 P2RX3 (0.61) P2RX3
SCHEMBL15081177 0.95 P2RX3 (0.61) P2RX3
SCHEMBL15064279 0.95 P2RX3 (0.61) P2RX3
SCHEMBL10057153 0.93 P2RX3 (0.54) P2RX3P2RX2
SCHEMBL17590775 0.90 P2RX3 (0.62) P2RX3
SCHEMBL10055480 0.88 P2RX3 (0.60) P2RX3
SCHEMBL10056367 0.88 P2RX3 (0.60) P2RX3
SCHEMBL19185100 0.86 P2RX3 (0.46) P2RX3P2RX2
SCHEMBL10057149 0.86 P2RX3 (0.57) P2RX3
SCHEMBL10056332 0.86 P2RX3 (0.61) P2RX3P2RX2

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 3 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
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