Sugi Predict

Sugi Predict / Compounds / SCHEMBL16451996

SCHEMBL16451996

SCHEMBL16451996

c1ccc(-c2nc(-c3ccccc3)nc(-c3cccc(-n4c5ccccc5c5c4ccc4c6ccccc6n(-c6nc(-c7cccc8c7oc7ccccc78)cc(-c7cccc8c7oc7ccccc78)n6)c45)c3)n2)cc1

nearest known ligand 0.34

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ ALOX5 P09917 2/20 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
SCHEMBL12691273 0.93 ALOX5 (0.38) ALOX5
SCHEMBL23602250 0.91 ALOX5 (0.33) ALOX5
SCHEMBL19769858 0.91 ALOX5 (0.34) ALOX5
SCHEMBL12691547 0.91 ALOX5 (0.38) ALOX5
SCHEMBL24914547 0.91 ALOX5 (0.38) ALOX5
SCHEMBL19769863 0.90 ALOX5 (0.35) ALOX5
SCHEMBL25964850 0.90 ALOX5 (0.34) ALOX5
SCHEMBL25964838 0.90 ALOX5 (0.34) ALOX5
SCHEMBL19769872 0.89 KDM4E (0.34) ALOX5
SCHEMBL16451997 0.88 ALOX5 (0.34) ALOX5

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