SCHEMBL25822841

SCHEMBL25822841

CC1(C)OB(c2ccccc2-c2cccc3ccc4ccccc4c23)OC1(C)C

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LPL P06858 2/20 0.39
LIPG Q9Y5X9 2/20 0.39
HSD17B10 Q99714 6/20 0.36
ALDH1A1 P00352 6/20 0.36
MAPK1 P28482 5/20 0.36
TSHR P16473 5/20 0.36
ATM Q13315 3/20 0.36
L3MBTL1 Q9Y468 3/20 0.36
HPGD P15428 4/20 0.35
CYP1A2 P05177 2/20 0.35
THRB P10828 2/20 0.35
JAK2 O60674 1/20 0.35
BTK Q06187 1/20 0.35
CASP1 P29466 4/20 0.33
HIF1A Q16665 3/20 0.33
CASP7 P55210 3/20 0.33
AHR P35869 2/20 0.33
RAB9A P51151 2/20 0.33
KDM4E B2RXH2 2/20 0.33
CYP3A4 P08684 2/20 0.33

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
SCHEMBL24770254 0.88 LPL (0.40) LPLLIPGHSD17B10ALDH1A1MAPK1
SCHEMBL26435797 0.88 LPL (0.43) LPLLIPGHSD17B10ALDH1A1MAPK1
SCHEMBL2674238 0.84 CYP1A2 (0.41) LPLLIPGHSD17B10ALDH1A1MAPK1
SCHEMBL31338572 0.83 KMT2A (0.35) LPLLIPGHSD17B10ALDH1A1MAPK1
SCHEMBL21425356 0.83 LPL (0.34) LPLLIPGJAK2BTKMEN1
SCHEMBL25273385 0.82 KEAP1 (0.43) LPLLIPGHSD17B10ALDH1A1MAPK1
SCHEMBL25668922 0.81 LPL (0.40) LPLLIPGHSD17B10ALDH1A1MAPK1
SCHEMBL29586872 0.81 LPL (0.44) LPLLIPGHSD17B10ALDH1A1MAPK1
SCHEMBL476862 0.81 LPL (0.44) LPLLIPGHSD17B10ALDH1A1MAPK1
SCHEMBL24770616 0.81 ENPP1 (0.44) LPLLIPG

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-2023113381-A1 COMPOUND FOR ORGANIC ELECTRICAL ELEMENT, ORGANIC ELECTRICAL ELEMENT USING SAME, AND ELECTRONIC DEVICE THEREOF 덕산네오룩스 주식회사 2023-06-22 WO disclosed