SCHEMBL30913098

SCHEMBL30913098

c1ccc(-n2c3ccccc3c3cc(-c4ccc5c(c4)c4ccccc4n5-c4ccc5c(c4)-c4ccccc4C54c5ccccc5-c5ccccc54)ccc32)cc1

nearest known ligand 0.46

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.46
KDM4E B2RXH2 1/20 0.46
ATM Q13315 1/20 0.46
HDAC4 P56524 1/20 0.34
PTGER4 P35408 1/20 0.33
EDNRB P24530 1/20 0.33
EDNRA P25101 1/20 0.33
TSPO P30536 1/20 0.32
KMT2A Q03164 2/20 0.32
IL1R1 P14778 1/20 0.32
MEN1 O00255 1/20 0.32
ALDH1A1 P00352 1/20 0.32
MAPT P10636 1/20 0.32
HTT P42858 1/20 0.32
PTPN1 P18031 2/20 0.30
PDK2 Q15119 1/20 0.30

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
SCHEMBL20633643 1.00 L3MBTL1 (0.46) L3MBTL1KDM4EATMHDAC4PTGER4
SCHEMBL21138923 0.96 KDM4E (0.39) L3MBTL1KDM4EATMHDAC4EDNRB
SCHEMBL20411906 0.95 KDM4E (0.39) L3MBTL1KDM4EATMHDAC4EDNRB
SCHEMBL22969682 0.95 KDM4E (0.49) L3MBTL1KDM4EATMHDAC4PTGER4
SCHEMBL15087893 0.95 KDM4E (0.49) L3MBTL1KDM4EATMHDAC4PTGER4
SCHEMBL23050948 0.94 KDM4E (0.41) L3MBTL1KDM4EATMHDAC4PTGER4
SCHEMBL17929465 0.94 KDM4E (0.41) L3MBTL1KDM4EATMHDAC4PTGER4
SCHEMBL18779578 0.94 KDM4E (0.43) L3MBTL1KDM4EATMHDAC4PTGER4
SCHEMBL20706761 0.93 KDM4E (0.42) L3MBTL1KDM4EATMHDAC4PTGER4
SCHEMBL20633642 0.92 L3MBTL1 (0.46) L3MBTL1KDM4EATMHDAC4PTGER4

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
CN-118139444-A Full-exciplex white light organic light-emitting diode with simple structure 吉林大学 2024-06-04 CN claimed
CN-118139444-A Full-exciplex white light organic light-emitting diode with simple structure 吉林大学 2024-06-04 CN disclosed