SCHEMBL22672199

SCHEMBL22672199

c1ccc(-c2ccc(-n3c4ccccc4c4cc(-c5ccc6c(c5)c5ccccc5n6-c5cccc(-c6cccc7sc8ccccc8c67)c5)ccc43)cc2)cc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.40
KDM4E B2RXH2 1/20 0.40
ATM Q13315 1/20 0.40
TSPO P30536 1/20 0.33
HDAC4 P56524 1/20 0.33
PIM3 Q86V86 1/20 0.33
ALOX5 P09917 1/20 0.33
ALK Q9UM73 1/20 0.32
PDE10A Q9Y233 1/20 0.32
HSD17B10 Q99714 1/20 0.32
BRDT Q58F21 1/20 0.32
LIMK1 P53667 1/20 0.31
KMT2A Q03164 2/20 0.31
IL1R1 P14778 1/20 0.31
PTGER4 P35408 1/20 0.31
MEN1 O00255 1/20 0.30
ALDH1A1 P00352 1/20 0.30
MAPT P10636 1/20 0.30
HTT P42858 1/20 0.30
F9 P00740 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
SCHEMBL18779548 0.99 ATM (0.41) L3MBTL1KDM4EATMTSPOHDAC4
SCHEMBL17660918 0.99 ATM (0.41) L3MBTL1KDM4EATMTSPOHDAC4
SCHEMBL24301467 0.98 L3MBTL1 (0.40) L3MBTL1KDM4EATMTSPOHDAC4
SCHEMBL22671815 0.98 ATM (0.39) L3MBTL1KDM4EATMTSPOHDAC4
SCHEMBL16545694 0.98 L3MBTL1 (0.42) L3MBTL1KDM4EATMTSPOHDAC4
SCHEMBL18779503 0.98 L3MBTL1 (0.42) L3MBTL1KDM4EATMTSPOHDAC4
SCHEMBL18779540 0.98 L3MBTL1 (0.42) L3MBTL1KDM4EATMTSPOHDAC4
SCHEMBL22672112 0.94 L3MBTL1 (0.39) L3MBTL1KDM4EATMTSPOPIM3
SCHEMBL17285326 0.94 L3MBTL1 (0.39) L3MBTL1KDM4EATMTSPOPIM3
SCHEMBL24173864 0.94 KDM4E (0.40) L3MBTL1KDM4EATMTSPOHDAC4

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
US-20200365811-A1 ORGANIC ELECTROLUMINESCENCE ELEMENT, ELECTRONIC DEVICE, COMPOSITION, MATERIAL FOR ORGANIC ELECTROLUMINESCENCE ELEMENT, AND COMPOSITION FILM IDEMITSU KOSAN CO.,LTD. (JP) 2020-11-19 US disclosed