SCHEMBL6370565

SCHEMBL6370565

c1ccc(-c2nc(-c3ccc(-c4ccc(-c5nc(-c6ccccc6)nc(-c6cccc7ccccc67)n5)cc4)cc3)nc(-c3cccc4ccccc34)n2)cc1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 7/20 0.57
ALDH1A1 P00352 7/20 0.57
HPGD P15428 7/20 0.57
SMN1; SMN2 Q16637 6/20 0.57
KDM4E B2RXH2 5/20 0.57
MAPK1 P28482 3/20 0.57
HSD17B10 Q99714 3/20 0.57
TSHR P16473 2/20 0.57
L3MBTL1 Q9Y468 2/20 0.57
ATM Q13315 2/20 0.57
TP53 P04637 2/20 0.57
NFKB1 P19838 1/20 0.57
NFKB2 Q00653 1/20 0.57
RELA Q04206 1/20 0.57
TDP1 Q9NUW8 1/20 0.57
ADORA3 P0DMS8 2/20 0.46
ADORA2A P29274 2/20 0.46
ADORA2B P29275 2/20 0.46
ADORA1 P30542 2/20 0.46
ALOX15 P16050 1/20 0.46

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
SCHEMBL23730320 1.00 MAPT (0.57) MAPTALDH1A1HPGDSMN1; SMN2KDM4E
SCHEMBL15274132 1.00 MAPT (0.57) MAPTALDH1A1HPGDSMN1; SMN2KDM4E
SCHEMBL2257581 1.00 MAPT (0.57) MAPTALDH1A1HPGDSMN1; SMN2KDM4E
SCHEMBL22096217 1.00 MAPT (0.57) MAPTALDH1A1HPGDSMN1; SMN2KDM4E
SCHEMBL15274131 1.00 MAPT (0.57) MAPTALDH1A1HPGDSMN1; SMN2KDM4E
SCHEMBL25668543 0.98 MAPT (0.56) MAPTALDH1A1HPGDSMN1; SMN2KDM4E
SCHEMBL25669054 0.98 MAPT (0.56) MAPTALDH1A1HPGDSMN1; SMN2KDM4E
SCHEMBL25668539 0.98 MAPT (0.56) MAPTALDH1A1HPGDSMN1; SMN2KDM4E
SCHEMBL23921204 0.96 MAPT (0.54) MAPTALDH1A1HPGDSMN1; SMN2KDM4E
SCHEMBL21524304 0.96 MAPT (0.61) MAPTALDH1A1HPGDSMN1; SMN2KDM4E

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-9085729-B2 Blue emitters for use in organic electroluminescence devices LG DISPLAY CO., LTD. (KR) 2015-07-21 US disclosed
US-20050175857-A1 Element including fluorescent 1,1'-binaphthyl derivative; uniform luminescence, saturated color; thermal stability; performance; vacuum deposition thin films; enhanced charge transporting, reduced driving voltage XEROX CORPORATION (US) 2005-08-11 US disclosed