SCHEMBL26048181

SCHEMBL26048181

c1ccc2c(c1)ccc1ccc3c(-c4nc(-c5ccc6c(c5)oc5ccccc56)nc(-c5ccc6c(c5)oc5ccccc56)n4)cccc3c12

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 2/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
AHR P35869 5/20 0.39
DUSP3 P51452 1/20 0.38
KDM4E B2RXH2 2/20 0.38
MEN1 O00255 2/20 0.38
ALDH1A1 P00352 2/20 0.38
MAPT P10636 2/20 0.38
KMT2A Q03164 2/20 0.38
HPGD P15428 1/20 0.38
ALOX5 P09917 1/20 0.37
CYP1A2 P05177 3/20 0.36
FYN P06241 2/20 0.36
HCRTR1 O43613 1/20 0.36
ERBB2 P04626 1/20 0.36
MAOA P21397 1/20 0.36
ACHE P22303 1/20 0.36
HTR2B P41595 1/20 0.36
ABCG2 Q9UNQ0 2/20 0.36
PAX8 Q06710 2/20 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
SCHEMBL26048205 0.96 TDP1 (0.42) TDP1L3MBTL1AHRDUSP3KDM4E
SCHEMBL26048204 0.96 TDP1 (0.39) TDP1L3MBTL1AHRDUSP3KDM4E
SCHEMBL26048244 0.95 ALDH1A1 (0.39) TDP1L3MBTL1AHRDUSP3KDM4E
SCHEMBL26048206 0.95 TDP1 (0.38) TDP1L3MBTL1AHRDUSP3KDM4E
SCHEMBL26435191 0.94 TDP1 (0.40) TDP1L3MBTL1AHRDUSP3KDM4E
SCHEMBL26435199 0.93 TDP1 (0.42) TDP1L3MBTL1AHRDUSP3KDM4E
SCHEMBL26048175 0.93 HCRTR1 (0.37) TDP1L3MBTL1AHRDUSP3KDM4E
SCHEMBL26048056 0.91 TDP1 (0.42) TDP1L3MBTL1AHRDUSP3KDM4E
SCHEMBL26435200 0.91 TDP1 (0.43) TDP1L3MBTL1AHRDUSP3KDM4E
SCHEMBL26047916 0.91 AHR (0.39) TDP1L3MBTL1AHRDUSP3KDM4E

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-2023153905-A1 COMPOSITION FOR ORGANIC OPTOELECTRONIC DIODE, ORGANIC OPTOELECTRONIC DIODE, AND DISPLAY DEVICE 삼성에스디아이 주식회사 2023-08-17 WO disclosed