SCHEMBL20159811

SCHEMBL20159811

CC1(C)c2ccccc2-c2cc3c4cc(-c5cccc6oc7ccc(-c8ccc9c(c8)c8ccccc8n9-c8ccc(-c9cccc%10c9oc9ccccc9%10)cc8)cc7c56)ccc4n(-c4ccccc4)c3cc21

nearest known ligand 0.36

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 1/20 0.36
PRKDC P78527 1/20 0.33
GGPS1 O95749 1/20 0.31

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
SCHEMBL24464034 0.98 ALOX5 (0.35) ALOX5PRKDCGGPS1
SCHEMBL20159800 0.94 KDM4E (0.32)
SCHEMBL20159801 0.93 KDM4E (0.33)
SCHEMBL20159877 0.93 KDM4E (0.33)
SCHEMBL17885311 0.93 ALOX5 (0.41) ALOX5PRKDCGGPS1
SCHEMBL20159762 0.92 KDM4E (0.32)
SCHEMBL20159806 0.92 KDM4E (0.32)
SCHEMBL20139057 0.92 KDM4E (0.32)
SCHEMBL30364790 0.92 KDM4E (0.32)
SCHEMBL20159447 0.92 KDM4E (0.32)

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
WO-2018087022-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2018-05-17 WO disclosed