SCHEMBL17590336

SCHEMBL17590336

COC(=O)[C@@H](C)Cn1c(=O)[nH]/c(=N\c2ccc(O[C@H](C)C(F)F)cc2)n(Cc2ccc(Cl)cc2)c1=O

nearest known ligand 0.53

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ P2RX3 P56373 20/20 0.53

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
SCHEMBL10055437 0.93 P2RX3 (0.61) P2RX3
SCHEMBL12047280 0.92 P2RX3 (0.60) P2RX3
SCHEMBL17590613 0.90 P2RX3 (0.62) P2RX3
SCHEMBL19185064 0.90 P2RX3 (0.62) P2RX3
SCHEMBL10055887 0.90 P2RX3 (0.62) P2RX3
SCHEMBL10055176 0.90 P2RX3 (0.61) P2RX3
SCHEMBL10055206 0.90 P2RX3 (0.61) P2RX3
SCHEMBL17590543 0.89 P2RX3 (0.62) P2RX3
SCHEMBL12047285 0.89 P2RX3 (0.61) P2RX3
SCHEMBL17683889 0.88 P2RX3 (0.49) 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
EP-2604595-B1 TRIAZINE DERIVATIVE AND PHARMACEUTICAL COMPOUND THAT CONTAINS SAME AND EXHIBITS ANALGESIC ACTIVITY SHIONOGI & CO (JP) 2016-03-16 — — EP disclosed
Send feedback