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SCHEMBL6259544

SCHEMBL6259544

CN(C)C(=O)Cn1ccn(-c2ccc(Cl)c(C(=O)NC(O)C3CCCCCC3)c2)c1=O.CNC(=O)Cn1c(C)cn(-c2ccc(Cl)c(C(=O)NC(O)C3CCCCCC3)c2)c1=O

nearest known ligand 0.35

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ P2RX7 Q99572 1/20 0.32
▸ CNR2 P34972 3/20 0.31
▸ CNR1 P21554 2/20 0.30

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
SCHEMBL5957156 0.90 P2RX7 (0.38) P2RX7CNR2CNR1
SCHEMBL5838779 0.89 P2RX7 (0.38) P2RX7CNR2CNR1
SCHEMBL5837167 0.89 P2RX7 (0.39) P2RX7CNR2CNR1
SCHEMBL6277608 0.87 P2RX7 (0.35) P2RX7CNR2CNR1
SCHEMBL6259125 0.86 P2RX7 (0.35) P2RX7CNR2CNR1
SCHEMBL6267690 0.85 P2RX3 (0.35) P2RX7CNR2CNR1
SCHEMBL6259548 0.82 P2RX7 (0.48) P2RX7
SCHEMBL6259712 0.82 P2RY12 (0.34) P2RX7CNR2CNR1
SCHEMBL5837231 0.82 P2RX7 (0.39) P2RX7CNR2CNR1
SCHEMBL6260746 0.81 P2RX7 (0.34) P2RX7CNR2CNR1

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