SCHEMBL4670865

SCHEMBL4670865

CC[n+]1c2ccccc2c(-c2c3ccccc3[n+](CC)c3ccccc23)c2ccccc21.O=[N+]([O-])[O-].O=[N+]([O-])[O-]

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.39
NPSR1 Q6W5P4 5/20 0.39
NPC1 O15118 4/20 0.39
RAB9A P51151 4/20 0.39
HTT P42858 3/20 0.39
KDM4E B2RXH2 2/20 0.39
S1PR4 O95977 1/20 0.39
S1PR1 P21453 1/20 0.39
ACHE P22303 5/20 0.36
LMNA P02545 5/20 0.33
MEN1 O00255 4/20 0.33
KMT2A Q03164 4/20 0.33
TERT O14746 2/20 0.33
PRKCA P17252 5/20 0.33
ALDH1A1 P00352 5/20 0.33
TSHR P16473 3/20 0.33
CYP3A4 P08684 3/20 0.33
TDP1 Q9NUW8 3/20 0.33
POLB P06746 3/20 0.33
BLM P54132 3/20 0.33

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
SCHEMBL29562542 0.79 ACHE (0.59) MAPTNPSR1NPC1RAB9AHTT
SCHEMBL29240 0.79 ACHE (0.59) MAPTNPSR1NPC1RAB9AHTT
Hydrochloric Acid SCHEMBL668151 0.77 ACHE (0.57) MAPTNPSR1NPC1RAB9AHTT
SCHEMBL17187158 0.73 HPGD (0.41) MAPTKDM4ELMNAMEN1KMT2A
SCHEMBL29684245 0.73 HPGD (0.41) MAPTKDM4ELMNAMEN1KMT2A
SCHEMBL6646299 0.72 PADI4 (0.38) MAPTNPSR1NPC1RAB9AHTT
Nitric Acid SCHEMBL29563050 0.72 ACHE (0.55) MAPTNPSR1NPC1RAB9AHTT
SCHEMBL5455552 0.71 ALDH1A1 (0.40) MAPTLMNAMEN1KMT2AALDH1A1
SCHEMBL10748957 0.70 MEN1 (0.33) MAPTNPSR1NPC1RAB9AHTT
SCHEMBL3425653 0.69 TERT (0.38) MAPTNPSR1NPC1RAB9AHTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0766825-B1 PREPARATION OF DERIVATIZED 10,10'-SUBSTITUTED-9,9'-BIACRIDINE LUMINESCENT MOLECULES AND SIGNAL SOLUTIONS KATSILOMETES GEORGE W (US) 2008-05-28 EP disclosed
US-20070031854-A1 Novel 10,10'-substituted-9,9'-biacridilidine luminescent molecules their preparation and uses KATSILOMETES GEORGE W 2007-02-08 US disclosed
US-20020034828-A1 NOVEL 10,10'-SUBSTITUTED-9,9'-BIACRIDINE LUMINESCENT MOLECULES AND THEIR PREPARATION PIERCE CHEMICAL COMPANY 2002-03-21 US disclosed
EP-1026156-A2 Novel 10, 10'-substituted-9,9'-biacridine luminescent molecules and their preparation PIERCE CHEMICAL COMPANY (US) 2000-08-09 EP disclosed
US-5866335-A Preparation of derivatized 10,10'-substituted-9,9'-biacridine luminescent molecules and signal solutions Katsilometes, George W. (US) 1999-02-02 US disclosed