SCHEMBL3724016

SCHEMBL3724016

Cc1cccc(C)c1N1CCN(Cc2cccc(C(F)(F)F)c2Cl)C(=O)C1=O

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
P2RX7 Q99572 20/20 1.00

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
SCHEMBL3721326 0.91 P2RX7 (1.00) P2RX7
SCHEMBL3722726 0.89 P2RX7 (1.00) P2RX7
SCHEMBL3719727 0.84 P2RX7 (1.00) P2RX7
SCHEMBL3720377 0.81 P2RX7 (1.00) P2RX7
SCHEMBL3720420 0.77 P2RX7 (1.00) P2RX7
SCHEMBL3726471 0.76 P2RX7 (1.00) P2RX7
SCHEMBL3723995 0.75 P2RX7 (1.00) P2RX7
SCHEMBL16027738 0.74 P2RX7 (0.76) P2RX7
SCHEMBL3723173 0.74 P2RX7 (1.00) P2RX7
SCHEMBL3730885 0.73 P2RX7 (1.00) 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2010125103-A1 DIKETOPIPERAZINE DERIVATIVES AS P2X7 MODULATORS GLAXO GROUP LIMITED (GB) 2010-11-04 WO claimed
WO-2010125103-A1 DIKETOPIPERAZINE DERIVATIVES AS P2X7 MODULATORS GLAXO GROUP LIMITED (GB) 2010-11-04 WO disclosed
WO-2010125103-A1 DIKETOPIPERAZINE DERIVATIVES AS P2X7 MODULATORS GLAXO GROUP LIMITED (GB) 2010-11-04 WO disclosed