SCHEMBL2709335

SCHEMBL2709335

Cc1ccc(-c2cc(C(=O)NCCc3cnccn3)cc(N3C(=O)OC[C@H]3C)c2)nc1

nearest known ligand 0.70

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
P2RX3 P56373 14/20 0.58
P2RX2 Q9UBL9 14/20 0.58

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
SCHEMBL2710839 0.91 P2RX3 (0.71) P2RX3P2RX2
SCHEMBL2711855 0.90 P2RX3 (0.72) P2RX3P2RX2
SCHEMBL2712186 0.89 P2RX3 (0.63) P2RX3P2RX2
SCHEMBL2709945 0.87 P2RX3 (0.69) P2RX3P2RX2
SCHEMBL2710320 0.83 P2RX3 (0.71) P2RX3P2RX2
SCHEMBL310488 0.82 P2RX3 (0.82) P2RX3P2RX2
SCHEMBL310487 0.82 P2RX3 (0.82) P2RX3P2RX2
SCHEMBL310678 0.82 P2RX3 (0.84) P2RX3P2RX2
SCHEMBL310677 0.82 P2RX3 (0.84) P2RX3P2RX2
SCHEMBL2709520 0.78 P2RX3 (0.73) 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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2445889-A1 NOVEL OXAZOLONE AND PYRROLIDINONE-SUBSTITUTED ARYLAMIDES F. Hoffmann-La Roche AG (CH) 2012-05-02 EP claimed
WO-2010149541-A1 NOVEL OXAZOLONE AND PYRROLIDINONE-SUBSTITUTED ARYLAMIDES F. HOFFMANN-LA ROCHE AG (CH) 2010-12-29 WO claimed
EP-2445889-A1 NOVEL OXAZOLONE AND PYRROLIDINONE-SUBSTITUTED ARYLAMIDES F. Hoffmann-La Roche AG (CH) 2012-05-02 EP disclosed
WO-2010149541-A1 NOVEL OXAZOLONE AND PYRROLIDINONE-SUBSTITUTED ARYLAMIDES F. HOFFMANN-LA ROCHE AG (CH) 2010-12-29 WO disclosed