SCHEMBL20828779

SCHEMBL20828779

c1ccc(-c2ccc(N(c3ccc(-c4ccccc4)cc3)c3ccc(-c4c(-c5ccc6oc7ccccc7c6c5-c5ccc(N(c6ccc(-c7ccccc7)cc6)c6cccc7c6oc6ccccc67)cc5)ccc5oc6ccccc6c45)cc3)cc2)cc1

nearest known ligand 0.36

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 3/20 0.36
CDC14B O60729 2/20 0.34
CDC14A Q9UNH5 2/20 0.34
PLA2G2A P14555 2/20 0.31
PLA2G4A P47712 2/20 0.31
CA1 P00915 1/20 0.31
CA2 P00918 1/20 0.31
KDM4E B2RXH2 1/20 0.31
ALDH1A1 P00352 1/20 0.31
LMNA P02545 1/20 0.31
GLA P06280 1/20 0.31
GAA P10253 1/20 0.31
TSHR P16473 1/20 0.31
HSD17B10 Q99714 1/20 0.31
ADORA2A P29274 1/20 0.30
PTPN1 P18031 1/20 0.30
PLA2G10 O15496 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
SCHEMBL20828759 0.99 ALOX5 (0.36) ALOX5CDC14BCDC14APLA2G2APLA2G4A
SCHEMBL20828764 0.92 ALOX5 (0.34) ALOX5CDC14BCDC14AKDM4EALDH1A1
SCHEMBL20828763 0.91 ALOX5 (0.37) ALOX5CDC14BCDC14A
SCHEMBL20828770 0.89 PLA2G2A (0.34) CDC14BCDC14APLA2G2APLA2G4ACA1
SCHEMBL20828765 0.89 PLA2G2A (0.34) CDC14BCDC14APLA2G2APLA2G4ACA1
SCHEMBL24781966 0.88 ALOX5 (0.36) ALOX5CDC14BCDC14APLA2G2APLA2G4A
SCHEMBL24781894 0.88 ALOX5 (0.36) ALOX5CDC14BCDC14APLA2G2APLA2G4A
SCHEMBL20828636 0.88 CA1 (0.38) CDC14BCDC14APLA2G2APLA2G4ACA1
SCHEMBL20828703 0.88 CA1 (0.38) CDC14BCDC14APLA2G2APLA2G4ACA1
SCHEMBL20828771 0.88 CA1 (0.38) CDC14BCDC14APLA2G2APLA2G4ACA1

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-2019054599-A1 ORGANIC LIGHT EMITTING COMPOUND AND ORGANIC ELECTROLUMINESCENT DEVICE USING SAME (주)피엔에이치테크 2019-03-21 WO disclosed