SCHEMBL29135050

SCHEMBL29135050

Clc1ccc(-c2ccccc2)cc1-c1cc(-c2cccc(-c3ccccc3)c2)nc(-c2ccccc2)n1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 9/20 0.49
KMT2A Q03164 9/20 0.49
ALDH1A1 P00352 7/20 0.49
HPGD P15428 7/20 0.49
MAPT P10636 6/20 0.49
KDM4E B2RXH2 4/20 0.49
LMNA P02545 3/20 0.49
GLA P06280 1/20 0.49
NTSR1 P30989 1/20 0.47
L3MBTL1 Q9Y468 3/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
MAOB P27338 3/20 0.42
TDP1 Q9NUW8 1/20 0.41
ADORA2A P29274 1/20 0.41
ADORA1 P30542 1/20 0.41
CTRC Q99895 1/20 0.41
MAOA P21397 1/20 0.40
NPSR1 Q6W5P4 1/20 0.39
RXFP1 Q9HBX9 1/20 0.39
CYP2C19 P33261 1/20 0.39

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
SCHEMBL29134686 0.88 MEN1 (0.49) MEN1KMT2AALDH1A1HPGDMAPT
SCHEMBL31637126 0.85 MEN1 (0.41) MEN1KMT2AALDH1A1HPGDMAPT
SCHEMBL25649367 0.85 MEN1 (0.43) MEN1KMT2AALDH1A1HPGDMAPT
SCHEMBL30775132 0.83 CTRC (0.57) MEN1KMT2AALDH1A1HPGDMAPT
SCHEMBL15458368 0.83 MEN1 (0.66) MEN1KMT2AALDH1A1HPGDMAPT
SCHEMBL14425948 0.83 MEN1 (0.66) MEN1KMT2AALDH1A1HPGDMAPT
SCHEMBL22308601 0.83 MEN1 (0.66) MEN1KMT2AALDH1A1HPGDMAPT
SCHEMBL22352161 0.83 MEN1 (0.66) MEN1KMT2AALDH1A1HPGDMAPT
SCHEMBL9920510 0.83 MEN1 (0.66) MEN1KMT2AALDH1A1HPGDMAPT
SCHEMBL14425575 0.83 MEN1 (0.66) MEN1KMT2AALDH1A1HPGDMAPT

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
CN-117343102-A Compound, organic electroluminescent device and display device SK株式会社 2024-01-05 CN disclosed