SCHEMBL16452285

SCHEMBL16452285

c1ccc(-c2cccc(-c3nc(-c4cccc(-c5ccccc5)c4)nc(-n4c5ccc(-c6ccccc6)cc5c5c6c7cc(-c8ccccc8)ccc7n(-c7cccc(-c8ccc9oc%10ccccc%10c9c8)n7)c6ccc54)n3)c2)cc1

nearest known ligand 0.36

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PLA2G2A P14555 3/20 0.36
PLA2G4A P47712 3/20 0.36
PLA2G10 O15496 1/20 0.36
PTPRF P10586 3/20 0.32
PTPN2 P17706 3/20 0.32
PTPN1 P18031 3/20 0.32
PRKDC P78527 1/20 0.31
CHEK2 O96017 1/20 0.31
CASP3 P42574 1/20 0.31
SENP7 Q9BQF6 1/20 0.31
SENP6 Q9GZR1 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
SCHEMBL16452239 0.97 PLA2G2A (0.36) PLA2G2APLA2G4APLA2G10PTPRFPTPN2
SCHEMBL16452135 0.94 PLA2G2A (0.35) PLA2G2APLA2G4APLA2G10CHEK2
SCHEMBL16452013 0.93 CHEK2 (0.33) PLA2G2APLA2G4APLA2G10PTPRFPTPN2
SCHEMBL16452241 0.92 CHEK2 (0.33) PLA2G2APLA2G4APLA2G10PTPRFPTPN2
SCHEMBL16452245 0.92 CHEK2 (0.34) PLA2G2APLA2G4APLA2G10PTPRFPTPN2
SCHEMBL16452174 0.91 PLA2G2A (0.36) PLA2G2APLA2G4APLA2G10PTPRFPTPN2
SCHEMBL20192176 0.90 PLA2G2A (0.35) PLA2G2APLA2G4APLA2G10PTPRFPTPN2
SCHEMBL16451939 0.90 PLA2G2A (0.31) PLA2G2APLA2G4APLA2G10
SCHEMBL16452114 0.89 PLA2G2A (0.37) PLA2G2APLA2G4APLA2G10PTPRFPTPN2
SCHEMBL16452261 0.89 CHEK2 (0.33) PLA2G2APLA2G4APLA2G10PTPRFPTPN2

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