SCHEMBL21573684

SCHEMBL21573684

c1ccc(-c2nc(-c3ccccc3)nc(-c3ccc4c(c3)oc3ccc5oc6cc(-c7ccc8c(c7)c7ccccc7n8-c7ccccc7)ccc6c5c34)n2)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 3/20 0.42
KDM4E B2RXH2 2/20 0.42
ATM Q13315 1/20 0.42
PTGER4 P35408 1/20 0.37
KMT2A Q03164 3/20 0.33
TSHR P16473 2/20 0.33
HSD17B10 Q99714 2/20 0.33
MEN1 O00255 2/20 0.33
ALDH1A1 P00352 2/20 0.33
MAPT P10636 2/20 0.33
POLB P06746 1/20 0.33
BRCA1 P38398 1/20 0.33
LMNA P02545 1/20 0.33
MAPK1 P28482 1/20 0.33
NPY5R Q15761 1/20 0.33
NPSR1 Q6W5P4 1/20 0.32
TSPO P30536 1/20 0.32
IL1R1 P14778 1/20 0.32
PGR P06401 1/20 0.32
SIRT2 Q8IXJ6 1/20 0.32

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
SCHEMBL22023470 0.94 L3MBTL1 (0.45) L3MBTL1KDM4EATMPTGER4KMT2A
SCHEMBL21913910 0.94 L3MBTL1 (0.45) L3MBTL1KDM4EATMPTGER4KMT2A
SCHEMBL21573733 0.93 KDM4E (0.40) L3MBTL1KDM4EATMPTGER4KMT2A
SCHEMBL21622543 0.93 KDM4E (0.42) L3MBTL1KDM4EATMPTGER4KMT2A
SCHEMBL21215344 0.93 KDM4E (0.42) L3MBTL1KDM4EATMPTGER4KMT2A
SCHEMBL21189477 0.93 KDM4E (0.42) L3MBTL1KDM4EATMPTGER4KMT2A
SCHEMBL24231136 0.93 L3MBTL1 (0.44) L3MBTL1KDM4EATMPTGER4KMT2A
SCHEMBL22240976 0.93 L3MBTL1 (0.44) L3MBTL1KDM4EATMPTGER4KMT2A
SCHEMBL23947812 0.92 KDM4E (0.41) L3MBTL1KDM4EATMPTGER4KMT2A
SCHEMBL23947806 0.92 KDM4E (0.41) L3MBTL1KDM4EATMPTGER4KMT2A

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
EP-3569603-A1 POLYCYCLIC COMPOUND, AND ORGANIC ELECTROLUMINESCENCE ELEMENT COMPRISING THE POLYCYCLIC COMPOUND Idemitsu Kosan Co., Ltd. (JP) 2019-11-20 EP disclosed