SCHEMBL25988905

SCHEMBL25988905

Clc1ccc(-c2ccccc2)c(-n2c3ccccc3c3ccc(-n4c5ccccc5c5ccccc54)cc32)c1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.42
KDM4E B2RXH2 1/20 0.42
ATM Q13315 1/20 0.42
IDO1 P14902 1/20 0.40
TDO2 P48775 1/20 0.40
IDO2 Q6ZQW0 1/20 0.40
MAPK14 Q16539 1/20 0.37
MDM2 Q00987 2/20 0.37
MAT2A P31153 7/20 0.36
MAPK8 P45983 1/20 0.35
MAPK9 P45984 1/20 0.35
ALDH1A1 P00352 1/20 0.35
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
RXFP1 Q9HBX9 1/20 0.35
PRMT5 O14744 1/20 0.34
LMNA P02545 1/20 0.34
CYP1A2 P05177 1/20 0.34
METAP2 P50579 1/20 0.34
HSD11B1 P28845 1/20 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
SCHEMBL25989011 0.92 L3MBTL1 (0.42) L3MBTL1KDM4EATMIDO1TDO2
SCHEMBL24948911 0.91 IDO1 (0.46) L3MBTL1KDM4EATMIDO1TDO2
SCHEMBL25989311 0.88 IDO1 (0.35) L3MBTL1KDM4EATMIDO1TDO2
SCHEMBL29892768 0.87 KDM4E (0.40) L3MBTL1KDM4EATMIDO1TDO2
SCHEMBL30257576 0.87 KDM4E (0.43) L3MBTL1KDM4EATMMAPK14MDM2
SCHEMBL29104468 0.87 KDM4E (0.40) L3MBTL1KDM4EATMIDO1TDO2
SCHEMBL29892286 0.87 KDM4E (0.40) L3MBTL1KDM4EATMIDO1TDO2
SCHEMBL27012169 0.85 KDM4E (0.43) L3MBTL1KDM4EATMIDO1TDO2
SCHEMBL30997590 0.85 KDM4E (0.41) L3MBTL1KDM4EATMMAPK14MDM2
SCHEMBL22172972 0.84 L3MBTL1 (0.43) L3MBTL1KDM4EATMMAPK14ALDH1A1

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-2023153906-A1 COMPOUND FOR ORGANIC OPTOELECTRONIC DEVICE, COMPOSITION FOR ORGANIC OPTOELECTRONIC DEVICE, ORGANIC OPTOELECTRONIC DEVICE, AND DISPLAY APPARATUS 삼성에스디아이 주식회사 2023-08-17 WO disclosed