SCHEMBL17590811

SCHEMBL17590811

CCOC(=O)CCn1c(=O)[nH]/c(=N\c2ccc(OC3CCC3)c(Cl)c2)n(Cc2ccc(C)cc2)c1=O

nearest known ligand 0.62

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ P2RX3 P56373 20/20 0.62

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
SCHEMBL10055553 0.98 P2RX3 (0.60) P2RX3
SCHEMBL10057025 0.95 P2RX3 (0.62) P2RX3
SCHEMBL19184354 0.93 P2RX3 (0.61) P2RX3
SCHEMBL19184227 0.91 P2RX3 (0.60) P2RX3
SCHEMBL16315079 0.90 P2RX3 (0.51) P2RX3
SCHEMBL10055722 0.90 P2RX3 (0.59) P2RX3
SCHEMBL17590753 0.89 P2RX3 (0.62) P2RX3
SCHEMBL10055522 0.89 P2RX3 (0.60) P2RX3
SCHEMBL15081512 0.89 P2RX3 (0.60) P2RX3
SCHEMBL19183887 0.89 P2RX3 (0.57) 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 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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