SCHEMBL20192176

SCHEMBL20192176

c1ccc(-c2ccc(-c3nc(-c4ccc(-c5ccccc5)cc4)nc(-n4c5ccc(-c6ccccc6)cc5c5cc6c7cc(-c8ccccc8)ccc7n(-c7cccc(-c8ccc9oc%10ccccc%10c9c8)n7)c6cc54)n3)cc2)cc1

nearest known ligand 0.35

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PLA2G2A P14555 3/20 0.35
PLA2G4A P47712 3/20 0.35
PLA2G10 O15496 1/20 0.34
PTPRF P10586 3/20 0.32
PTPN2 P17706 3/20 0.32
PTPN1 P18031 3/20 0.32
CHEK2 O96017 1/20 0.31
CASP3 P42574 1/20 0.31
SENP7 Q9BQF6 1/20 0.31
SENP6 Q9GZR1 1/20 0.31
KDM4E B2RXH2 1/20 0.31
MEN1 O00255 1/20 0.31
ALDH1A1 P00352 1/20 0.31
LMNA P02545 1/20 0.31
GLA P06280 1/20 0.31
MAPT P10636 1/20 0.31
HPGD P15428 1/20 0.31
KMT2A Q03164 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
SCHEMBL16452306 0.98 PLA2G2A (0.34) PLA2G2APLA2G4APLA2G10PTPRFPTPN2
SCHEMBL12691276 0.95 CHEK2 (0.33) PLA2G2APLA2G4APLA2G10PTPRFPTPN2
SCHEMBL16452278 0.94 PLA2G2A (0.35) PLA2G2APLA2G4APLA2G10PTPRFPTPN2
SCHEMBL16674248 0.92 CHEK2 (0.34) PLA2G2APLA2G4APLA2G10PTPRFPTPN2
SCHEMBL16452075 0.92 CHEK2 (0.35) PLA2G2APLA2G4APLA2G10PTPRFPTPN2
SCHEMBL16452254 0.91 KDM4E (0.33) PTPRFPTPN2PTPN1CHEK2KDM4E
SCHEMBL16452285 0.90 PLA2G2A (0.36) PLA2G2APLA2G4APLA2G10PTPRFPTPN2
SCHEMBL16452239 0.90 PLA2G2A (0.36) PLA2G2APLA2G4APLA2G10PTPRFPTPN2
SCHEMBL16452013 0.89 CHEK2 (0.33) PLA2G2APLA2G4APLA2G10PTPRFPTPN2
SCHEMBL16452066 0.89 PLA2G2A (0.37) 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 2 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