SCHEMBL24948911

SCHEMBL24948911

Clc1ccc(-c2ccccc2)c(-n2c3ccccc3c3ccccc32)c1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 1/20 0.46
TDO2 P48775 1/20 0.46
IDO2 Q6ZQW0 1/20 0.46
KDM4E B2RXH2 3/20 0.46
L3MBTL1 Q9Y468 2/20 0.46
ATM Q13315 1/20 0.46
ALDH1A1 P00352 2/20 0.40
KMT2A Q03164 3/20 0.40
MEN1 O00255 2/20 0.40
RXFP1 Q9HBX9 1/20 0.40
MAPK14 Q16539 1/20 0.39
MDM2 Q00987 1/20 0.38
HSD17B10 Q99714 2/20 0.38
HSD11B1 P28845 1/20 0.38
MAPK1 P28482 1/20 0.37
APAF1 O14727 1/20 0.37
CYP1A2 P05177 2/20 0.36
NPC1 O15118 2/20 0.36
RAB9A P51151 2/20 0.36
SMN1; SMN2 Q16637 2/20 0.36

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
SCHEMBL25988905 0.91 L3MBTL1 (0.42) IDO1TDO2IDO2KDM4EL3MBTL1
SCHEMBL25989011 0.91 L3MBTL1 (0.42) IDO1TDO2IDO2KDM4EL3MBTL1
SCHEMBL21147596 0.91 IDO1 (0.42) IDO1TDO2IDO2KDM4EL3MBTL1
SCHEMBL27012178 0.90 CYP1A2 (0.47) IDO1TDO2IDO2KDM4EL3MBTL1
SCHEMBL29892768 0.90 KDM4E (0.40) IDO1TDO2IDO2KDM4EL3MBTL1
SCHEMBL29104468 0.90 KDM4E (0.40) IDO1TDO2IDO2KDM4EL3MBTL1
SCHEMBL29892286 0.90 KDM4E (0.40) IDO1TDO2IDO2KDM4EL3MBTL1
SCHEMBL27012205 0.88 IDO1 (0.39) IDO1TDO2IDO2KDM4EL3MBTL1
SCHEMBL21147245 0.87 APAF1 (0.46) IDO1KDM4EL3MBTL1ATMALDH1A1
SCHEMBL30257431 0.86 MAT2A (0.40) IDO1TDO2IDO2KDM4EL3MBTL1

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-2023002447-A1 ORGANIC LIGHT-EMITTING DEVICE 주식회사 엘지화학 2023-01-26 WO disclosed
WO-2023003403-A1 ORGANIC LIGHT-EMITTING DEVICE 주식회사 엘지화학 2023-01-26 WO disclosed