SCHEMBL20208630

SCHEMBL20208630

c1ccc(-c2nc(-c3ccccc3)nc(-n3c4ccccc4c4c5c6c(cc43)Oc3ccccc3N6c3ccccc3O5)n2)cc1

nearest known ligand 0.37

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
P2RX4 Q99571 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
SCHEMBL20208650 0.91
SCHEMBL20208970 0.91 MEN1 (0.30)
SCHEMBL20208933 0.90 KDM4E (0.30)
SCHEMBL20208653 0.88
SCHEMBL20208797 0.88 ALDH1A1 (0.39)
SCHEMBL20208801 0.88 HSD17B10 (0.38)
SCHEMBL20208941 0.86 CYP1A2 (0.35)
SCHEMBL20208937 0.86 MAPT (0.32)
SCHEMBL22812481 0.86 ALDH1A1 (0.37)
SCHEMBL20209210 0.86 P2RX4 (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