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SCHEMBL6256995

SCHEMBL6256995

Cc1cn(-c2ccc(Cl)c(C(=O)NC(O)C3CCCCCC3)c2)c(=O)n1CCCOC1CCNC1.O=C(NC(O)C1CCCCCC1)c1cc(-n2ccn(CCCOC3CCNC3)c2=O)ccc1Cl

nearest known ligand 0.32

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ P2RX7 Q99572 1/20 0.32
▸ CNR2 P34972 1/20 0.31
▸ MEN1 O00255 1/20 0.30
▸ ALDH1A1 P00352 1/20 0.30
▸ LMNA P02545 1/20 0.30
▸ MAPT P10636 1/20 0.30
▸ CRHBP P24387 1/20 0.30
▸ HTT P42858 1/20 0.30
▸ KMT2A Q03164 1/20 0.30
▸ CRHR2 Q13324 1/20 0.30
▸ NPSR1 Q6W5P4 1/20 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
SCHEMBL5838647 0.95 P2RX7 (0.34) P2RX7CNR2MEN1ALDH1A1LMNA
SCHEMBL5838063 0.93 P2RX7 (0.36) P2RX7CNR2
SCHEMBL6277961 0.91 P2RX7 (0.30) P2RX7
SCHEMBL5838069 0.91 P2RX7 (0.35) P2RX7CNR2MEN1ALDH1A1LMNA
SCHEMBL5839265 0.90 P2RX7 (0.37) P2RX7CNR2MEN1ALDH1A1LMNA
SCHEMBL6271005 0.89 P2RX7 (0.34) P2RX7
SCHEMBL5837840 0.89 P2RX7 (0.36) P2RX7CNR2
SCHEMBL5957070 0.88 P2RX7 (0.39) P2RX7CNR2
SCHEMBL6256990 0.85 P2RX7 (0.45) P2RX7
SCHEMBL5837246 0.84 P2RX7 (0.37) P2RX7CNR2ALDH1A1LMNAMAPT

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