SCHEMBL17850239

SCHEMBL17850239

C=Cc1cc(F)ccc1C(=O)N1CCn2c(nnc2-c2cccc(Cl)c2)C1

nearest known ligand 0.79

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
P2RX7 Q99572 20/20 0.79

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
SCHEMBL108095 0.88 P2RX7 (1.00) P2RX7
SCHEMBL106213 0.82 P2RX7 (1.00) P2RX7
SCHEMBL17850272 0.80 P2RX7 (0.77) P2RX7
SCHEMBL107332 0.79 P2RX7 (1.00) P2RX7
SCHEMBL17850254 0.79 P2RX7 (0.78) P2RX7
SCHEMBL17850245 0.79 P2RX7 (0.77) P2RX7
SCHEMBL17850273 0.79 P2RX7 (0.54) P2RX7
SCHEMBL110564 0.77 P2RX7 (1.00) P2RX7
SCHEMBL107128 0.77 P2RX7 (1.00) P2RX7
SCHEMBL110571 0.77 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
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 disclosed