SCHEMBL17836815

SCHEMBL17836815

Cn1ccc(-c2nnc3n2CCN(C(=O)c2cccc(C(F)(F)F)c2Cl)C3)c1

nearest known ligand 0.77

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
P2RX7 Q99572 20/20 0.77

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
SCHEMBL9931040 0.87 P2RX7 (1.00) P2RX7
SCHEMBL108641 0.86 P2RX7 (1.00) P2RX7
SCHEMBL109251 0.85 P2RX7 (1.00) P2RX7
SCHEMBL108537 0.85 P2RX7 (1.00) P2RX7
SCHEMBL109074 0.85 P2RX7 (1.00) P2RX7
SCHEMBL109182 0.84 P2RX7 (1.00) P2RX7
SCHEMBL107522 0.83 P2RX7 (0.81) P2RX7
SCHEMBL9931044 0.83 P2RX7 (1.00) P2RX7
SCHEMBL109008 0.82 P2RX7 (0.77) P2RX7
SCHEMBL111226 0.82 P2RX7 (0.75) 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