SCHEMBL4716449

SCHEMBL4716449

Nc1ccc(Oc2ccc(Nc3ccc(Nc4ccccc4)cc3)cc2)c(N)c1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.53
ALDH1A1 P00352 5/20 0.53
CYP1A2 P05177 3/20 0.53
CYP2C9 P11712 3/20 0.53
CYP2C19 P33261 3/20 0.53
CYP3A4 P08684 3/20 0.53
HTT P42858 3/20 0.53
ALOX12 P18054 2/20 0.53
L3MBTL1 Q9Y468 2/20 0.53
TDP1 Q9NUW8 3/20 0.49
MEN1 O00255 3/20 0.49
KMT2A Q03164 3/20 0.49
GAA P10253 3/20 0.49
KDM4E B2RXH2 3/20 0.49
LMNA P02545 2/20 0.49
GFER P55789 1/20 0.49
MAOA P21397 1/20 0.44
IKBKB O14920 1/20 0.44
ALOX15 P16050 3/20 0.44
HPGD P15428 3/20 0.44

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
SCHEMBL4715484 1.00 MAPT (0.53) MAPTALDH1A1CYP1A2CYP2C9CYP2C19
SCHEMBL5438255 1.00 MAPT (0.53) MAPTALDH1A1CYP1A2CYP2C9CYP2C19
SCHEMBL5438877 1.00 MAPT (0.53) MAPTALDH1A1CYP1A2CYP2C9CYP2C19
SCHEMBL4716451 0.86 NCOA1 (0.47) MAPTALDH1A1CYP1A2CYP2C9CYP2C19
SCHEMBL7511939 0.85 NCOA1 (0.44) MAPTALDH1A1CYP1A2CYP2C9CYP2C19
SCHEMBL28417223 0.84 MAOA (0.63) MAPTALDH1A1CYP1A2CYP2C9CYP2C19
SCHEMBL3114464 0.84 CYP1A2 (0.67) MAPTALDH1A1CYP1A2CYP2C9CYP2C19
SCHEMBL29382755 0.84 CYP1A2 (0.67) MAPTALDH1A1CYP1A2CYP2C9CYP2C19
Hydrochloric Acid SCHEMBL8642598 0.83 CYP1A2 (0.65) MAPTALDH1A1CYP1A2CYP2C9CYP2C19
SCHEMBL7806773 0.82 MAPT (0.59) MAPTALDH1A1CYP1A2CYP2C9CYP2C19

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 8 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8822039-B2 Charge-transporting varnish and organic electro-luminescent devices made by using the same NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2014-09-02 US disclosed
EP-1248497-B1 ELECTROLUMINESCENCE ELEMENT NISSAN CHEMICAL IND LTD (JP) 2008-10-15 EP disclosed
EP-1248497-B1 ELECTROLUMINESCENCE ELEMENT NISSAN CHEMICAL IND LTD (JP) 2008-10-15 EP disclosed
US-20070187672-A1 Charge-transporting varnish and organic electro-luminescent devices made by using the same NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2007-08-16 US disclosed
EP-1728827-A1 CHARGE-TRANSPORTING VARNISH AND ORGANIC ELECTRO- LUMINESCENT DEVICES MADE BY USING THE SAME Nissan Chemical Industries, Ltd. (JP) 2006-12-06 EP disclosed
US-6821648-B2 SALT OF AN ELECTRON ACCEPTING DOPANE AND POLYIMIDE OBTAINED FROM A DIAMINE COMPONENT CONTAINING AT LEAST 1 MOL % OF AN OLIGO-ANILINE UNIT-BEARING DIAMINOBENZENE DERIVATIVE AND A TETRACARBOXYLIC DIANHYDRIDE OR DERIVATIVE Kido, Junji (JP) 2004-11-23 US disclosed
US-20020197494-A1 Electroluminescent element NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2002-12-26 US disclosed
EP-1248497-A1 ELECTROLUMINESCENCE ELEMENT Nissan Chemical Industries, Ltd. (JP) 2002-10-09 EP disclosed