SCHEMBL21119623

SCHEMBL21119623

c1ccc(-c2ccc3ccc4ccc(-c5c6ccccc6c(-c6ccc7c(ccc8oc9ccccc9c87)c6)c6ccccc56)nc4c3n2)cc1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
ABCG2 Q9UNQ0 4/20 0.34
CYP1A1 P04798 1/20 0.34
CYP1A2 P05177 1/20 0.34
FYN P06241 1/20 0.34
MAPK3 P27361 1/20 0.34
AHR P35869 1/20 0.34
PAX8 Q06710 1/20 0.34
MAPK1 P28482 1/20 0.33
KMT2A Q03164 1/20 0.33
PARP1 P09874 1/20 0.32
PGR P06401 1/20 0.32
PLA2G2A P14555 2/20 0.32
PLA2G4A P47712 2/20 0.32
CASP3 P42574 1/20 0.31
SENP7 Q9BQF6 1/20 0.31
SENP6 Q9GZR1 1/20 0.31
HCRTR1 O43613 1/20 0.31
CLK4 Q9HAZ1 2/20 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
SCHEMBL21119612 0.90 PGR (0.40) TDP1L3MBTL1ABCG2CYP1A1CYP1A2
SCHEMBL21120141 0.88 AHR (0.37) TDP1L3MBTL1CYP1A2AHRCASP3
SCHEMBL21119823 0.87 TDO2 (0.36) TDP1L3MBTL1ABCG2CYP1A1CYP1A2
SCHEMBL21119602 0.86 ADORA2A (0.35) ABCG2CYP1A1CYP1A2MAPK1KMT2A
SCHEMBL21119619 0.86 MAPK1 (0.38) TDP1L3MBTL1ABCG2CYP1A1CYP1A2
SCHEMBL21119949 0.85 MAPK1 (0.37) TDP1L3MBTL1ABCG2CYP1A1CYP1A2
SCHEMBL20127342 0.85 TDP1 (0.43) TDP1L3MBTL1ABCG2CYP1A1CYP1A2
SCHEMBL20412618 0.84 ESR1 (0.42) TDP1L3MBTL1ABCG2CYP1A1CYP1A2
SCHEMBL21119961 0.83 TDO2 (0.38) TDP1L3MBTL1MAPK1KMT2APARP1
SCHEMBL20127505 0.82 PGR (0.44) TDP1L3MBTL1ABCG2CYP1A1CYP1A2

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-11522139-B2 Organic light emitting diode LG DISPLAY CO., LTD. (KR) 2022-12-06 US disclosed
US-20190207123-A1 ORGANIC LIGHT EMITTING DIODE LG CHEM, LTD. (KR) 2019-07-04 US disclosed