SCHEMBL6276504

SCHEMBL6276504

Cc1ccc(C2(CNC(=O)c3cc(-n4nc(C)[nH]c4=O)ccc3Cl)CCCCC2)cc1.Cc1nn(-c2ccc(Cl)c(C(=O)NCCc3ccccc3Cl)c2)c(=O)[nH]1

nearest known ligand 0.56

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
P2RX7 Q99572 17/20 0.56
ABCB11 O95342 1/20 0.56
SPR P35270 1/20 0.40

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
SCHEMBL5838233 0.91 P2RX7 (0.56) P2RX7
SCHEMBL5837770 0.86 P2RX7 (0.73) P2RX7ABCB11
SCHEMBL6276507 0.81 P2RX7 (0.54) P2RX7ABCB11
SCHEMBL1412881 0.80 P2RX7 (0.73) P2RX7ABCB11SPR
SCHEMBL5839002 0.79 P2RX7 (0.73) P2RX7
SCHEMBL5838136 0.79 P2RX7 (0.73) P2RX7
SCHEMBL5837470 0.76 P2RX7 (0.59) P2RX7SPR
SCHEMBL1412923 0.75 P2RX7 (0.76) P2RX7ABCB11SPR
SCHEMBL1415261 0.74 P2RX7 (0.74) P2RX7ABCB11SPR
SCHEMBL5838546 0.74 P2RX7 (0.57) 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