SCHEMBL25501758

SCHEMBL25501758

c1ccc2cc(-c3nc(-c4ccc5ccc6oc7ccccc7c6c5c4)nc(-c4cccc5c(-c6cccc7oc8ccccc8c67)cccc45)n3)ccc2c1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PIM1 P11309 3/20 0.38
TDP1 Q9NUW8 2/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
ALDH1A1 P00352 4/20 0.35
MAPT P10636 4/20 0.35
NPC1 O15118 2/20 0.34
RAB9A P51151 2/20 0.34
CYP1A1 P04798 1/20 0.34
CYP1B1 Q16678 1/20 0.34
CASP3 P42574 1/20 0.34
SENP7 Q9BQF6 1/20 0.34
SENP6 Q9GZR1 1/20 0.34
CYP1A2 P05177 1/20 0.34
CYP2C9 P11712 1/20 0.34
CYP2C19 P33261 1/20 0.34
KDM4E B2RXH2 2/20 0.34
MEN1 O00255 2/20 0.34
KMT2A Q03164 2/20 0.34
ESR1 P03372 1/20 0.34
POLB P06746 1/20 0.34

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
SCHEMBL25501445 0.99 PIM1 (0.37) PIM1TDP1L3MBTL1ALDH1A1MAPT
SCHEMBL25501767 0.96 PIM1 (0.36) PIM1TDP1L3MBTL1ALDH1A1MAPT
SCHEMBL25501453 0.95 PIM1 (0.35) PIM1TDP1L3MBTL1ALDH1A1MAPT
SCHEMBL25501426 0.95 TDP1 (0.38) PIM1TDP1L3MBTL1ALDH1A1MAPT
SCHEMBL25501895 0.94 L3MBTL1 (0.38) PIM1TDP1L3MBTL1ALDH1A1MAPT
SCHEMBL25501776 0.94 PIM1 (0.40) PIM1TDP1L3MBTL1ALDH1A1MAPT
SCHEMBL25847252 0.94 CASP3 (0.38) PIM1TDP1L3MBTL1ALDH1A1MAPT
SCHEMBL23821783 0.94 CHEK2 (0.37) PIM1TDP1L3MBTL1ALDH1A1MAPT
SCHEMBL25501599 0.94 MAPT (0.37) PIM1TDP1L3MBTL1ALDH1A1MAPT
SCHEMBL25847558 0.94 TDP1 (0.35) PIM1TDP1L3MBTL1ALDH1A1MAPT

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
WO-2023132694-A1 ORGANIC LIGHT-EMITTING DEVICE 주식회사 엘지화학 2023-07-13 WO disclosed
WO-2023096318-A1 NOVEL COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE COMPRISING SAME 주식회사 엘지화학 2023-06-01 WO disclosed