SCHEMBL13064293

SCHEMBL13064293

Cc1cccc(C(=O)N2CCn3c(nnc3-c3ccc(F)cc3)C2)c1Cl

nearest known ligand 0.82

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
P2RX7 Q99572 20/20 0.82

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
SCHEMBL111184 0.90 P2RX7 (1.00) P2RX7
SCHEMBL109074 0.87 P2RX7 (1.00) P2RX7
SCHEMBL112251 0.86 P2RX7 (1.00) P2RX7
SCHEMBL9972032 0.81 P2RX7 (0.83) P2RX7
SCHEMBL107414 0.80 P2RX7 (0.82) P2RX7
SCHEMBL108468 0.80 P2RX7 (0.85) P2RX7
SCHEMBL9972034 0.80 P2RX7 (0.84) P2RX7
SCHEMBL9972031 0.80 P2RX7 (0.84) P2RX7
SCHEMBL107128 0.80 P2RX7 (1.00) P2RX7
SCHEMBL108641 0.78 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2010125102-A1 5,6,7,8-TETRAHYDRO[1,2,4]TRIAZOLO[4,3-a]PYRAZINE DERIVATIVES AS P2X7 MODULATORS GLAXO GROUP LIMITED (GB) 2010-11-04 WO disclosed