SCHEMBL15965697

SCHEMBL15965697

c1ccc(-c2ccc3c(c2)c2ncccc2n3-c2ccc3oc4ccccc4c3c2)c(-c2ccc3c(c2)c2ncccc2n3-c2ccc3oc4ccccc4c3c2)c1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.38
NPC1 O15118 2/20 0.38
ALOX5 P09917 1/20 0.35
HSP90AA1 P07900 1/20 0.34
HSP90AB1 P08238 1/20 0.34
KDM4E B2RXH2 4/20 0.33
ALDH1A1 P00352 3/20 0.33
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
HPGD P15428 2/20 0.33
RAB9A P51151 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
CHEK2 O96017 1/20 0.32
PDE4D Q08499 3/20 0.32
NCOA1 Q15788 1/20 0.32
GNRHR P30968 1/20 0.32
AHR P35869 1/20 0.31
TNIK Q9UKE5 1/20 0.31
GAA P10253 1/20 0.30
HSD17B10 Q99714 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
SCHEMBL15965690 0.94 NPC1 (0.35) MAPTNPC1ALOX5HSP90AA1HSP90AB1
SCHEMBL12396561 0.94 NPC1 (0.34) MAPTNPC1ALOX5HSP90AA1HSP90AB1
SCHEMBL21365316 0.94 NPC1 (0.34) MAPTNPC1ALOX5HSP90AA1HSP90AB1
SCHEMBL13471329 0.92 NPC1 (0.30) MAPTNPC1
SCHEMBL15317249 0.92 MAPT (0.39) MAPTNPC1HSP90AA1HSP90AB1KDM4E
SCHEMBL15317296 0.92 MAPT (0.39) MAPTNPC1HSP90AA1HSP90AB1KDM4E
SCHEMBL17264907 0.91 MAPT (0.43) MAPTNPC1KDM4EALDH1A1MEN1
SCHEMBL16625763 0.91 MAPT (0.43) MAPTNPC1KDM4EALDH1A1MEN1
SCHEMBL17264917 0.91 MAPK14 (0.33) MAPTNPC1PDE4DAHR
SCHEMBL16606295 0.91 MAPK14 (0.33) MAPTNPC1PDE4DAHR

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-20140231772-A1 MATERIAL FOR ORGANIC ELECTROLUMINESCENT ELEMENTS, AND ORGANIC ELECTROLUMINESCENT ELEMENT USING THE SAME IDEMITSU KOSAN CO., LTD. 2014-08-21 US disclosed
US-20140231772-A1 MATERIAL FOR ORGANIC ELECTROLUMINESCENT ELEMENTS, AND ORGANIC ELECTROLUMINESCENT ELEMENT USING THE SAME IDEMITSU KOSAN CO., LTD. 2014-08-21 US disclosed