SCHEMBL21755596

SCHEMBL21755596

c1ccc(-c2cc(-c3ccccc3)nc(-c3ccc(-n4c5ccccc5c5c(-c6ccc(-c7cc(-c8ccc(-n9c%10ccccc%10c%10ccc%11c%12ccccc%12oc%11c%109)cc8)nc(-c8ccccc8)n7)cc6)cc6c7ccccc7oc6c54)cc3)n2)cc1

nearest known ligand 0.37

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.33
ALDH1A1 P00352 4/20 0.33
KDM4E B2RXH2 3/20 0.33
HPGD P15428 3/20 0.33
MAPK1 P28482 2/20 0.33
TDP1 Q9NUW8 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
MEN1 O00255 2/20 0.32
KMT2A Q03164 2/20 0.32
NTSR1 P30989 1/20 0.32
TSHR P16473 2/20 0.32
LMNA P02545 1/20 0.32
HSD17B10 Q99714 1/20 0.32
POLB P06746 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
ALOX5 P09917 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
SCHEMBL19862894 0.95 MAPT (0.35) MAPTALDH1A1KDM4EHPGDMAPK1
SCHEMBL21755595 0.93 MAPT (0.32) MAPTALDH1A1KDM4EHPGDMAPK1
SCHEMBL17246065 0.91 MAPT (0.38) MAPTALDH1A1KDM4EHPGDMAPK1
SCHEMBL15625547 0.91 MAPT (0.38) MAPTALDH1A1KDM4EHPGDMAPK1
SCHEMBL19862908 0.91 MAPT (0.33) MAPTALDH1A1KDM4EHPGDMAPK1
SCHEMBL19863090 0.91 MAPT (0.37) MAPTALDH1A1KDM4EHPGDMAPK1
SCHEMBL19863087 0.91 MAPT (0.37) MAPTALDH1A1KDM4EHPGDMAPK1
SCHEMBL24173807 0.90 MAPT (0.37) MAPTALDH1A1KDM4EHPGDMAPK1
SCHEMBL19862893 0.90 KDM4E (0.33) MAPTALDH1A1KDM4EHPGDMAPK1
SCHEMBL18996080 0.90 MAPT (0.35) MAPTALDH1A1KDM4EHPGDMAPK1

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-10573839-B2 Organic light-emitting device SAMSUNG DISPLAY CO., LTD. (KR) 2020-02-25 US disclosed