SCHEMBL24154497

SCHEMBL24154497

c1ccc(N(c2ccccc2)c2cccc3cc(-c4ccc(N(c5ccccc5)c5cc6ccccc6c6oc7ccccc7c56)cc4)ccc23)cc1

nearest known ligand 0.33

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PLA2G2A P14555 3/20 0.32
PLA2G4A P47712 3/20 0.32
L3MBTL1 Q9Y468 3/20 0.32
TDP1 Q9NUW8 1/20 0.32
CYP1A1 P04798 2/20 0.31
CYP1B1 Q16678 2/20 0.31
CYP1A2 P05177 1/20 0.31
KDM4E B2RXH2 1/20 0.31
MEN1 O00255 1/20 0.31
CYP3A4 P08684 1/20 0.31
ALPI P09923 1/20 0.31
GAA P10253 1/20 0.31
MAPT P10636 1/20 0.31
PKM P14618 1/20 0.31
HPGD P15428 1/20 0.31
CASP3 P42574 1/20 0.31
RECQL P46063 1/20 0.31
BLM P54132 1/20 0.31
CASP7 P55210 1/20 0.31
CASP6 P55212 1/20 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
SCHEMBL24888102 0.91 L3MBTL1 (0.35) PLA2G2APLA2G4AL3MBTL1TDP1CYP1A1
SCHEMBL24824906 0.90 CYP1A1 (0.38) PLA2G2APLA2G4AL3MBTL1TDP1CYP1A1
SCHEMBL26380461 0.89 PLA2G2A (0.36) PLA2G2APLA2G4AL3MBTL1TDP1CYP1A1
SCHEMBL24826962 0.89 CYP1A1 (0.34) PLA2G2APLA2G4ACYP1A1CYP1B1CYP1A2
SCHEMBL26490186 0.88 CYP1A1 (0.36) PLA2G2APLA2G4AL3MBTL1TDP1CYP1A1
SCHEMBL24154553 0.88 HCRTR1 (0.35) PLA2G2APLA2G4AL3MBTL1TDP1KDM4E
SCHEMBL24826628 0.88 CYP1A1 (0.33) PLA2G2APLA2G4AL3MBTL1TDP1CYP1A1
SCHEMBL24886897 0.86 PLA2G2A (0.33) PLA2G2APLA2G4AL3MBTL1CYP1A1CYP1B1
SCHEMBL26490534 0.86 PGR (0.35) PLA2G2APLA2G4AL3MBTL1TDP1CYP1A1
SCHEMBL24825275 0.86 CA12 (0.36) L3MBTL1TDP1CYP1A1CYP1B1CYP1A2

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-2021261962-A1 ORGANIC LIGHT-EMITTING DEVICE 주식회사 엘지화학 2021-12-30 WO disclosed