SCHEMBL15470201

SCHEMBL15470201

c1ccc(-c2ccc(-c3ccc4c(c3)Sc3ccccc3N4c3ccc(-c4ccc(-c5ccc6oc7ccccc7c6c5)cc4)cc3)cc2)cc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PLA2G2A P14555 5/20 0.40
PLA2G4A P47712 5/20 0.40
HDAC6 Q9UBN7 1/20 0.37
PLA2G10 O15496 1/20 0.36
PRKDC P78527 3/20 0.36
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
SMN1; SMN2 Q16637 2/20 0.35
KDM4E B2RXH2 1/20 0.35
NPC1 O15118 1/20 0.35
ALDH1A1 P00352 1/20 0.35
MAPT P10636 1/20 0.35
HPGD P15428 1/20 0.35
RAB9A P51151 1/20 0.35
BCHE P06276 1/20 0.34
AHR P35869 1/20 0.33
ADRA2A P08913 1/20 0.32
ADRA2B P18089 1/20 0.32
ADRA2C P18825 1/20 0.32
CHRM3 P20309 1/20 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
SCHEMBL15470193 0.96 PLA2G2A (0.42) PLA2G2APLA2G4APLA2G10PRKDCMEN1
SCHEMBL13827523 0.96 PLA2G2A (0.42) PLA2G2APLA2G4APLA2G10PRKDCMEN1
SCHEMBL15470194 0.94 HDAC6 (0.41) PLA2G2APLA2G4AHDAC6PLA2G10PRKDC
SCHEMBL17278451 0.92 HDAC6 (0.36) PLA2G2APLA2G4AHDAC6PLA2G10PRKDC
SCHEMBL20114213 0.90 PLA2G2A (0.33) PLA2G2APLA2G4AHDAC6PLA2G10PRKDC
SCHEMBL17278621 0.90 PLA2G2A (0.38) PLA2G2APLA2G4AHDAC6PLA2G10PRKDC
SCHEMBL13827529 0.90 PLA2G2A (0.38) PLA2G2APLA2G4APLA2G10PRKDCMEN1
SCHEMBL15470202 0.90 PLA2G2A (0.38) PLA2G2APLA2G4APLA2G10PRKDCMEN1
SCHEMBL15469994 0.89 PLA2G2A (0.33) PLA2G2APLA2G4AHDAC6PLA2G10PRKDC
SCHEMBL17278648 0.88 PLA2G2A (0.36) PLA2G2APLA2G4AHDAC6PLA2G10PRKDC

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-20140042412-A1 COMPOUND FOR ORGANIC OPTOELECTRONIC DEVICE, ORGANIC LIGHT-EMITTING DIODE INCLUDING THE SAME AND DISPLAY DEVICE INCLUDING THE ORGANIC LIGHT-EMITTING DIODE CHEIL INDUSTRIES, INC. (KR) 2014-02-13 US disclosed
US-20140042412-A1 COMPOUND FOR ORGANIC OPTOELECTRONIC DEVICE, ORGANIC LIGHT-EMITTING DIODE INCLUDING THE SAME AND DISPLAY DEVICE INCLUDING THE ORGANIC LIGHT-EMITTING DIODE CHEIL INDUSTRIES, INC. (KR) 2014-02-13 US disclosed