SCHEMBL19907334

SCHEMBL19907334

CCCOc1ccc(C)c(Nc2nc(=O)c(OC)cn2Cc2cc(F)cc(Cl)c2)c1

nearest known ligand 0.88

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
P2RX7 Q99572 20/20 0.88

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
SCHEMBL19906864 0.93 P2RX7 (1.00) P2RX7
SCHEMBL19906823 0.92 P2RX7 (1.00) P2RX7
SCHEMBL19906868 0.89 P2RX7 (1.00) P2RX7
SCHEMBL19907627 0.88 P2RX7 (1.00) P2RX7
SCHEMBL20106913 0.88 P2RX7 (1.00) P2RX7
SCHEMBL19907672 0.88 P2RX7 (1.00) P2RX7
SCHEMBL19906857 0.88 P2RX7 (1.00) P2RX7
SCHEMBL19907327 0.87 P2RX7 (0.83) P2RX7
SCHEMBL19906703 0.87 P2RX7 (1.00) P2RX7
SCHEMBL19906895 0.87 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