SCHEMBL19986158

SCHEMBL19986158

c1ccc(-c2cc(-c3ccccc3)nc(-n3c4ccccc4c4cc5c6ccccc6n(-c6nc(-c7ccccc7)cc(-c7ccccc7)n6)c5cc43)n2)cc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 8/20 0.42
KMT2A Q03164 8/20 0.42
L3MBTL1 Q9Y468 6/20 0.42
HPGD P15428 5/20 0.42
SMN1; SMN2 Q16637 4/20 0.42
ALDH1A1 P00352 4/20 0.42
ADORA2A P29274 1/20 0.42
ADORA1 P30542 1/20 0.42
MAPT P10636 8/20 0.41
KDM4E B2RXH2 6/20 0.41
MAPK1 P28482 2/20 0.41
NPSR1 Q6W5P4 2/20 0.41
ATM Q13315 2/20 0.40
ACHE P22303 1/20 0.40
HTT P42858 1/20 0.39
TDP1 Q9NUW8 3/20 0.39
AGTR1 P30556 1/20 0.39
TSHR P16473 1/20 0.39
NTSR1 P30989 1/20 0.38
LMNA P02545 4/20 0.37

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
SCHEMBL10027569 0.95 MEN1 (0.43) MEN1KMT2AL3MBTL1HPGDSMN1; SMN2
SCHEMBL17279653 0.94 MEN1 (0.47) MEN1KMT2AL3MBTL1HPGDSMN1; SMN2
SCHEMBL10018652 0.94 L3MBTL1 (0.51) MEN1KMT2AL3MBTL1HPGDSMN1; SMN2
SCHEMBL16362424 0.94 MEN1 (0.40) MEN1KMT2AL3MBTL1HPGDSMN1; SMN2
SCHEMBL8816904 0.93 MEN1 (0.47) MEN1KMT2AL3MBTL1HPGDSMN1; SMN2
SCHEMBL17548780 0.93 L3MBTL1 (0.50) MEN1KMT2AL3MBTL1HPGDSMN1; SMN2
SCHEMBL21388866 0.92 MEN1 (0.46) MEN1KMT2AL3MBTL1HPGDSMN1; SMN2
SCHEMBL19769708 0.92 L3MBTL1 (0.49) MEN1KMT2AL3MBTL1HPGDSMN1; SMN2
SCHEMBL19769733 0.92 L3MBTL1 (0.49) MEN1KMT2AL3MBTL1HPGDSMN1; SMN2
SCHEMBL17279647 0.92 L3MBTL1 (0.45) MEN1KMT2AL3MBTL1HPGDSMN1; SMN2

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
US-20180083202-A1 COMPOUND FOR ORGANIC OPTOELECTRIC DEVICE, COMPOSITION FOR ORGANIC OPTOELECTRIC DEVICE AND ORGANIC OPTOELECTRIC DEVICE AND DISPLAY DEVICE SAMSUNG SDI CO., LTD. (KR) 2018-03-22 US disclosed
US-20180083202-A1 COMPOUND FOR ORGANIC OPTOELECTRIC DEVICE, COMPOSITION FOR ORGANIC OPTOELECTRIC DEVICE AND ORGANIC OPTOELECTRIC DEVICE AND DISPLAY DEVICE SAMSUNG SDI CO., LTD. (KR) 2018-03-22 US disclosed