SCHEMBL20071371

SCHEMBL20071371

c1ccc(-c2nc(-c3cccc(-c4ccc5oc6c(ccc7ccc8c(c9cccc%10c%11ccccc%11n8c%109)c76)c5c4)c3)nc(-c3ccc4ccccc4c3)n2)cc1

nearest known ligand 0.32

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PLA2G10 O15496 1/20 0.32
PLA2G2A P14555 1/20 0.32
PLA2G4A P47712 1/20 0.32
KDM4E B2RXH2 1/20 0.31
MEN1 O00255 1/20 0.31
ALDH1A1 P00352 1/20 0.31
TP53 P04637 1/20 0.31
CYP1A2 P05177 1/20 0.31
KMT2A Q03164 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
HSD17B10 Q99714 1/20 0.31
PTPRF P10586 1/20 0.30
PTPN2 P17706 1/20 0.30
PTPN1 P18031 1/20 0.30

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
SCHEMBL25479973 0.85 PLA2G2A (0.37) PLA2G10PLA2G2APLA2G4AKDM4EMEN1
SCHEMBL26246086 0.83 PLA2G2A (0.35) PLA2G10PLA2G2APLA2G4AKDM4EMEN1
SCHEMBL20068485 0.81 PLA2G2A (0.34) PLA2G10PLA2G2APLA2G4AKDM4EMEN1
SCHEMBL26246112 0.81 PLA2G2A (0.34) PLA2G10PLA2G2APLA2G4AKDM4EMEN1
SCHEMBL23486998 0.81 PLA2G2A (0.34) PLA2G10PLA2G2APLA2G4AALDH1A1CYP1A2
SCHEMBL26246079 0.81 KDM4E (0.33) KDM4EMEN1ALDH1A1TP53CYP1A2
SCHEMBL26246076 0.80 CYP1A2 (0.35) PLA2G10PLA2G2APLA2G4AKDM4EMEN1
SCHEMBL20071512 0.80 MEN1 (0.34) MEN1KMT2A
SCHEMBL25479730 0.80 PLA2G2A (0.38) PLA2G10PLA2G2APLA2G4AKDM4EMEN1
SCHEMBL20071686 0.79 CYP1A2 (0.34) CYP1A2

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-2018070836-A1 COMPOUND FOR ORGANIC ELECTRONIC DEVICE, ORGANIC ELECTRONIC DEVICE USING SAME AND ELECTRONIC APPARATUS THEREFOR 덕산네오룩스 주식회사 2018-04-19 WO disclosed