SCHEMBL20208960

SCHEMBL20208960

c1ccc2c(c1)Oc1cc3c4ccccc4n(-c4nc(-c5ccc(-c6cccc7c6oc6ccccc67)cc5)c5ccccc5n4)c3c3c1N2c1ccccc1O3

nearest known ligand 0.33

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 1/20 0.33
PRKDC P78527 1/20 0.32

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
SCHEMBL20208736 0.94 ALOX5 (0.30) ALOX5
SCHEMBL20209198 0.93 ALOX5 (0.35) ALOX5PRKDC
SCHEMBL20208972 0.90 ALOX5 (0.33) ALOX5PRKDC
SCHEMBL20208802 0.89 CHEK2 (0.30)
SCHEMBL20208799 0.87 ALDH1A1 (0.39)
SCHEMBL22812516 0.83
SCHEMBL22812507 0.83 DHODH (0.34)
SCHEMBL20208800 0.82 ALDH1A1 (0.37)
SCHEMBL22812376 0.82
SCHEMBL20208936 0.81 ALDH1A1 (0.34)

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