SCHEMBL15062834

SCHEMBL15062834

COc1ncccc1N(C)c1ncnc2c1CN(c1ccc(C)cc1C#N)CC2

nearest known ligand 0.53

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
P2RX3 P56373 20/20 0.53
P2RX2 Q9UBL9 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
SCHEMBL2859985 0.81 P2RX3 (0.63) P2RX3P2RX2
SCHEMBL2874116 0.80 P2RX3 (0.63) P2RX3P2RX2
SCHEMBL15062835 0.78 P2RX3 (0.72) P2RX3P2RX2
SCHEMBL14028384 0.76 P2RX3 (0.64) P2RX3P2RX2
SCHEMBL2877810 0.75 P2RX3 (0.63) P2RX3P2RX2
SCHEMBL2867391 0.74 P2RX3 (0.64) P2RX3P2RX2
SCHEMBL2873989 0.74 P2RX3 (0.64) P2RX3P2RX2
SCHEMBL2863394 0.74 P2RX3 (0.64) P2RX3P2RX2
SCHEMBL2863803 0.73 P2RX3 (0.63) P2RX3P2RX2
SCHEMBL2865823 0.71 P2RX3 (0.62) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2139334-B1 2-CYANOPHENYL FUSED HETEROCYCLIC COMPOUNDS, AND COMPOSITIONS AND USES THEREOF EVOTEC AG (DE) 2013-07-03 EP disclosed