SCHEMBL16239135

SCHEMBL16239135

COc1cc(N2C(=O)CC(=O)Nc3c2ccc2ccccc32)ccc1N(C(=O)O)C(C)(C)C

nearest known ligand 0.54

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
P2RX4 Q99571 20/20 0.54

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
SCHEMBL16267239 0.81 P2RX4 (0.62) P2RX4
SCHEMBL28427619 0.80 P2RX4 (0.56) P2RX4
SCHEMBL16238922 0.80 P2RX4 (0.60) P2RX4
SCHEMBL16239111 0.79 P2RX4 (0.55) P2RX4
SCHEMBL29908736 0.79 P2RX4 (0.55) P2RX4
SCHEMBL16386099 0.74 P2RX4 (0.73) P2RX4
SCHEMBL16239109 0.73 P2RX4 (0.73) P2RX4
SCHEMBL30094427 0.73 P2RX4 (0.73) P2RX4
SCHEMBL16238942 0.73 P2RX4 (0.52) P2RX4
SCHEMBL16239063 0.73 P2RX4 (0.69) P2RX4

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-2803662-A1 P2X4 RECEPTOR ANTAGONIST Nippon Chemiphar Co., Ltd. (JP) 2014-11-19 EP disclosed