SCHEMBL17836818

SCHEMBL17836818

O=C(c1ccc(Cl)c(F)c1Cl)N1CCn2c(nnc2-c2cnns2)C1

nearest known ligand 0.65

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
P2RX7 Q99572 20/20 0.65

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
SCHEMBL106802 0.85 P2RX7 (0.66) P2RX7
SCHEMBL109849 0.85 P2RX7 (0.68) P2RX7
SCHEMBL108343 0.83 P2RX7 (0.62) P2RX7
SCHEMBL109180 0.82 P2RX7 (0.69) P2RX7
SCHEMBL109010 0.81 P2RX7 (0.70) P2RX7
SCHEMBL108944 0.81 P2RX7 (0.68) P2RX7
SCHEMBL108978 0.80 P2RX7 (0.67) P2RX7
SCHEMBL106739 0.80 P2RX7 (0.80) P2RX7
SCHEMBL107961 0.79 P2RX7 (0.76) P2RX7
SCHEMBL9972010 0.79 P2RX7 (0.68) 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
EP-2424869-B1 5,6,7,8-TETRAHYDRO[1,2,4]TRIAZOLO[4,3-a]PYRAZINE DERIVATIVES AS P2X7 MODULATORS GLAXO GROUP LTD (GB) 2016-06-22 EP claimed