SCHEMBL26131069

SCHEMBL26131069

CC1(C)OB(c2ccc(-c3nc(-c4ccccc4)nc(-c4ccccc4)n3)cc2C#N)OC1(C)C

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LPL P06858 2/20 0.43
LIPG Q9Y5X9 2/20 0.43
ALDH1A1 P00352 5/20 0.38
LMNA P02545 2/20 0.38
KDM4E B2RXH2 1/20 0.38
HTT P42858 1/20 0.38
RXFP1 Q9HBX9 1/20 0.38
THRB P10828 1/20 0.38
ABCG2 Q9UNQ0 6/20 0.37
MEN1 O00255 3/20 0.35
KMT2A Q03164 3/20 0.35
CYP1A2 P05177 2/20 0.35
CYP2C9 P11712 2/20 0.35
CYP2C19 P33261 2/20 0.35
CYP3A4 P08684 1/20 0.35
CYP2D6 P10635 1/20 0.35
TSHR P16473 1/20 0.35
HSD17B10 Q99714 1/20 0.35
CLK4 Q9HAZ1 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35

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
SCHEMBL30616366 1.00 LPL (0.43) LPLLIPGALDH1A1LMNAKDM4E
SCHEMBL26132441 0.90 LPL (0.43) LPLLIPGALDH1A1LMNAKDM4E
SCHEMBL28482373 0.88 LIPG (0.53) LPLLIPGALDH1A1LMNAKDM4E
SCHEMBL25709644 0.83 MCL1 (0.36) LPLLIPGALDH1A1LMNAABCG2
SCHEMBL24780967 0.81 LIPG (0.47) LPLLIPGALDH1A1LMNAKDM4E
SCHEMBL20923013 0.80 LIPG (0.46) LPLLIPGALDH1A1LMNAKDM4E
SCHEMBL29458188 0.80 L3MBTL1 (0.44) LPLLIPGLMNAHTTTSHR
SCHEMBL25383675 0.80 L3MBTL1 (0.44) LPLLIPGLMNAHTTTSHR
SCHEMBL24780493 0.79 LIPG (0.47) LPLLIPGALDH1A1LMNAKDM4E
SCHEMBL23383843 0.78 LIPG (0.55) LPLLIPGALDH1A1LMNAKDM4E

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-2023195735-A1 NOVEL COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE USING SAME 주식회사 엘지화학 2023-10-12 WO disclosed
WO-2023195735-A1 NOVEL COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE USING SAME 주식회사 엘지화학 2023-10-12 WO disclosed