SCHEMBL25501776

SCHEMBL25501776

c1ccc2cc(-c3nc(-c4ccc5c(-c6cccc7oc8ccccc8c67)cccc5c4)nc(-c4ccc5ccc6oc7ccccc7c6c5c4)n3)ccc2c1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PIM1 P11309 3/20 0.40
TDP1 Q9NUW8 2/20 0.38
L3MBTL1 Q9Y468 2/20 0.38
ALDH1A1 P00352 6/20 0.37
MAPT P10636 5/20 0.37
CYP1A1 P04798 1/20 0.36
CYP1B1 Q16678 1/20 0.36
HSD17B10 Q99714 4/20 0.36
HPGD P15428 3/20 0.36
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
KDM4E B2RXH2 4/20 0.35
ATM Q13315 2/20 0.35
CYP1A2 P05177 2/20 0.35
CYP2C19 P33261 2/20 0.35
RAB9A P51151 2/20 0.35
MAOA P21397 1/20 0.35
MAOB P27338 1/20 0.35
GAA P10253 1/20 0.34
TP53 P04637 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
SCHEMBL25501782 0.97 PIM1 (0.38) PIM1TDP1L3MBTL1ALDH1A1MAPT
SCHEMBL25501902 0.96 L3MBTL1 (0.39) PIM1TDP1L3MBTL1ALDH1A1MAPT
SCHEMBL25501610 0.95 L3MBTL1 (0.38) PIM1TDP1L3MBTL1ALDH1A1MAPT
SCHEMBL25501606 0.95 L3MBTL1 (0.38) PIM1TDP1L3MBTL1ALDH1A1MAPT
SCHEMBL25503638 0.95 L3MBTL1 (0.40) PIM1TDP1L3MBTL1ALDH1A1MAPT
SCHEMBL25501907 0.94 PLA2G2A (0.38) PIM1TDP1L3MBTL1ALDH1A1MAPT
SCHEMBL25502063 0.94 ALDH1A1 (0.38) PIM1TDP1L3MBTL1ALDH1A1MAPT
SCHEMBL25847560 0.94 ALDH1A1 (0.41) PIM1TDP1L3MBTL1ALDH1A1MAPT
SCHEMBL25501780 0.94 TDP1 (0.37) PIM1TDP1L3MBTL1ALDH1A1MAPT
SCHEMBL25501758 0.94 PIM1 (0.38) 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