SCHEMBL20209210

SCHEMBL20209210

c1ccc(-c2nc(-c3ccccc3)nc(-n3c4ccccc4c4cc5c6c(c43)Oc3ccccc3N6c3ccccc3O5)n2)cc1

nearest known ligand 0.33

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
P2RX4 Q99571 1/20 0.31
PDE4B Q07343 1/20 0.30

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
SCHEMBL20209209 0.90 MEN1 (0.31)
SCHEMBL22812377 0.90 KDM4E (0.31)
SCHEMBL22812430 0.88 TSHR (0.39)
SCHEMBL20208799 0.88 ALDH1A1 (0.39) PDE4B
SCHEMBL20208630 0.86 P2RX4 (0.30) P2RX4
SCHEMBL22812396 0.85 GLA (0.31)
SCHEMBL22145875 0.84 NPY5R (0.31) P2RX4
SCHEMBL22812484 0.83
SCHEMBL20209181 0.83 KDM4E (0.42) P2RX4
SCHEMBL22145867 0.83 NPC1 (0.31) P2RX4

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3544986-B1 BRIDGED TRIARYLAMINES FOR ELECTRONIC DEVICES MERCK PATENT GMBH (DE) 2020-12-23 EP disclosed
WO-2018095839-A1 BRIDGED TRIARYLAMINES FOR ELECTRONIC DEVICES MERCK PATENT GMBH (DE) 2018-05-31 WO disclosed