SCHEMBL6259548

SCHEMBL6259548

CN(C)C(=O)Cn1ccn(-c2ccc(Cl)c(C(=O)NCC3(O)CCCCCC3)c2)c1=O.CNC(=O)Cn1c(C)cn(-c2ccc(Cl)c(C(=O)NCC3(O)CCCCCC3)c2)c1=O

nearest known ligand 0.48

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
P2RX7 Q99572 19/20 0.48
IL1B P01584 1/20 0.41

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
SCHEMBL5837473 0.90 P2RX7 (0.57) P2RX7
SCHEMBL5838773 0.89 P2RX7 (0.56) P2RX7
SCHEMBL5837157 0.89 P2RX7 (0.58) P2RX7IL1B
SCHEMBL6277609 0.88 P2RX7 (0.51) P2RX7
SCHEMBL6259129 0.87 P2RX7 (0.53) P2RX7
SCHEMBL6259541 0.83 P2RX7 (0.48) P2RX7IL1B
SCHEMBL6267685 0.83 P2RX7 (0.46) P2RX7
SCHEMBL5837221 0.83 P2RX7 (0.57) P2RX7
SCHEMBL6259544 0.82 P2RX7 (0.32) P2RX7
SCHEMBL5837080 0.82 P2RX7 (0.59) P2RX7

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1581507-A1 BENZAMIDE INHIBITORS OF THE P2X7 RECEPTOR Pfizer Products Inc. (US) 2005-10-05 EP disclosed
WO-2004058731-A1 BENZAMIDE INHIBITORS OF THE P2X7 RECEPTOR PFIZER PRODUCTS INC. (US) 2004-07-15 WO disclosed