SCHEMBL19907007

SCHEMBL19907007

COc1cn(Cc2ccccc2)c(NC2=C(F)C=CCC2)nc1=O

nearest known ligand 0.61

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
P2RX7 Q99572 20/20 0.61

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
SCHEMBL19907020 0.78 P2RX7 (0.84) P2RX7
SCHEMBL19906921 0.77 P2RX7 (0.83) P2RX7
SCHEMBL19906744 0.76 P2RX7 (0.84) P2RX7
SCHEMBL19907055 0.76 P2RX7 (0.68) P2RX7
SCHEMBL19907117 0.76 P2RX7 (0.90) P2RX7
SCHEMBL20106824 0.76 P2RX7 (0.64) P2RX7
SCHEMBL19907687 0.76 P2RX7 (1.00) P2RX7
SCHEMBL19906640 0.75 P2RX7 (1.00) P2RX7
SCHEMBL19907962 0.75 P2RX7 (1.00) P2RX7
SCHEMBL19906719 0.75 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-3287443-A1 6-MEMBERED HETEROCYCLIC DERIVATIVE AND PHARMACEUTICAL COMPOSITION COMPRISING SAME Shionogi & Co., Ltd (JP) 2018-02-28 EP disclosed