SCHEMBL23288296

SCHEMBL23288296

Clc1cc2c3cccc4sc5cccc(c5c43)n3c4ccc(-c5ccc6oc7ccccc7c6c5)cc4c(c1)c23

nearest known ligand 0.33

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
AHR P35869 3/20 0.33
PLA2G2A P14555 2/20 0.32
PLA2G4A P47712 2/20 0.32
PLA2G10 O15496 1/20 0.32
KDM4E B2RXH2 1/20 0.31
MEN1 O00255 1/20 0.31
NPC1 O15118 1/20 0.31
ALDH1A1 P00352 1/20 0.31
MAPT P10636 1/20 0.31
HPGD P15428 1/20 0.31
RAB9A P51151 1/20 0.31
KMT2A Q03164 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
IDO1 P14902 1/20 0.30
LMNA P02545 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
SCHEMBL21453607 0.92 PLA2G2A (0.34) AHRPLA2G2APLA2G4APLA2G10KDM4E
SCHEMBL21453631 0.89 PLA2G2A (0.35) AHRPLA2G2APLA2G4APLA2G10KDM4E
SCHEMBL21453608 0.86 AHR (0.33) AHRPLA2G2APLA2G4APLA2G10KDM4E
SCHEMBL21453633 0.84 AHR (0.34) AHRPLA2G2APLA2G4APLA2G10KDM4E
SCHEMBL21453507 0.83 PLA2G2A (0.33) PLA2G2APLA2G4APLA2G10KDM4EMEN1
SCHEMBL23288295 0.83 LPL (0.32)
SCHEMBL23288194 0.82 KDM4E (0.38) KDM4EMEN1NPC1ALDH1A1MAPT
SCHEMBL23288234 0.81 AHR (0.40) AHRPLA2G2APLA2G4APLA2G10IDO1
SCHEMBL21453610 0.80 ALOX5 (0.45)
SCHEMBL21453776 0.79 TSPO (0.34)

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-2021080333-A1 COMPOUND FOR ORGANIC ELECTRIC ELEMENT, ORGANIC ELECTRIC ELEMENT USING SAME, AND ELECTRONIC DEVICE THEREFOR 덕산네오룩스 주식회사 2021-04-29 WO disclosed