SCHEMBL5767253

SCHEMBL5767253

O=C(O)CNC1CCN(c2ccc3c(C(=O)NCC4CCCCC4)c(Cl)ccc3n2)C1

nearest known ligand 0.68

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
P2RX7 Q99572 20/20 0.68

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
SCHEMBL3842793 1.00 P2RX7 (0.68) P2RX7
SCHEMBL1802127 0.90 P2RX7 (0.82) P2RX7
Hydrochloric Acid SCHEMBL3839613 0.90 P2RX7 (0.81) P2RX7
SCHEMBL3837384 0.87 P2RX7 (0.64) P2RX7
SCHEMBL3837373 0.86 P2RX7 (0.75) P2RX7
SCHEMBL5767624 0.85 P2RX7 (0.69) P2RX7
SCHEMBL1805240 0.85 P2RX7 (0.69) P2RX7
SCHEMBL1805331 0.85 P2RX7 (0.69) P2RX7
SCHEMBL1806738 0.85 P2RX7 (0.68) P2RX7
Hydrochloric Acid SCHEMBL3837926 0.85 P2RX7 (0.74) 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-1633717-A1 NEW P2X7 RECEPTOR ANTAGONISTS AND THEIR USE AstraZeneca AB (SE) 2006-03-15 EP disclosed
WO-2004106305-A1 NEW P2X7 RECEPTOR ANTAGONISTS AND THEIR USE ASTRAZENECA AB (SE) 2004-12-09 WO disclosed