SCHEMBL16451997

SCHEMBL16451997

c1ccc(-c2ccc(-c3cc(-c4ccc(-c5ccccc5)cc4)cc(-n4c5ccccc5c5c4ccc4c6ccccc6n(-c6nc(-c7ccccc7)cc(-c7cccc8c7oc7ccccc78)n6)c45)c3)cc2)cc1

nearest known ligand 0.34

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 2/20 0.34
PRKDC P78527 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
SCHEMBL19769863 0.95 ALOX5 (0.35) ALOX5PRKDC
SCHEMBL19769858 0.93 ALOX5 (0.34) ALOX5PRKDC
SCHEMBL16811005 0.91 ALOX5 (0.35) ALOX5PRKDC
SCHEMBL12691547 0.91 ALOX5 (0.38) ALOX5PRKDC
SCHEMBL16810920 0.90 ALOX5 (0.34) ALOX5PRKDC
SCHEMBL16811088 0.89 ALOX5 (0.32) ALOX5
SCHEMBL16811036 0.89 ALOX5 (0.35) ALOX5PRKDC
SCHEMBL16810990 0.88 ALOX5 (0.39) ALOX5PRKDC
SCHEMBL16451996 0.88 ALOX5 (0.32) ALOX5
SCHEMBL16452048 0.88 ALOX5 (0.34) ALOX5PRKDC

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9985219-B2 Organic electroluminescent element NIPPON STEEL & SUMIKIN CHEMICAL CO., LTD. (JP) 2018-05-29 US disclosed
US-9985219-B2 Organic electroluminescent element NIPPON STEEL & SUMIKIN CHEMICAL CO., LTD. (JP) 2018-05-29 US disclosed
US-20150041785-A1 ORGANIC ELECTROLUMINESCENT ELEMENT NIPPON STEEL CHEMICAL & MATERIAL CO., LTD. (JP) 2015-02-12 US disclosed
US-20150041785-A1 ORGANIC ELECTROLUMINESCENT ELEMENT NIPPON STEEL CHEMICAL & MATERIAL CO., LTD. (JP) 2015-02-12 US disclosed