SCHEMBL6572326

SCHEMBL6572326

CC(Br)Oc1ccc([N+](=O)[O-])cc1-n1cccc1

nearest known ligand 0.68

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
RECQL P46063 1/20 0.43
LMNA P02545 3/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
NPSR1 Q6W5P4 2/20 0.41
TDP1 Q9NUW8 6/20 0.40
L3MBTL1 Q9Y468 2/20 0.40
HTT P42858 2/20 0.38
MAPT P10636 2/20 0.38
CYP19A1 P11511 2/20 0.38
MEN1 O00255 2/20 0.37
KMT2A Q03164 2/20 0.37
ALDH1A1 P00352 2/20 0.36
CYP3A4 P08684 1/20 0.36
MAPK1 P28482 1/20 0.36

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
SCHEMBL10914480 0.78 CYP19A1 (0.51) RECQLLMNASMN1; SMN2NPSR1TDP1
SCHEMBL6575768 0.77 ALDH1A1 (0.50) LMNASMN1; SMN2TDP1MAPTMEN1
SCHEMBL6572322 0.76 MAPT (0.41) RECQLLMNASMN1; SMN2NPSR1TDP1
SCHEMBL28343073 0.76 HTT (0.57) LMNASMN1; SMN2TDP1HTTMAPT
SCHEMBL13253426 0.73 TDP1 (0.56) LMNANPSR1TDP1L3MBTL1HTT
SCHEMBL2061679 0.72 PTGDR2 (0.61) RECQLLMNASMN1; SMN2NPSR1TDP1
SCHEMBL27708625 0.71 GRIK1 (0.51) LMNASMN1; SMN2NPSR1TDP1L3MBTL1
SCHEMBL1744862 0.70 ALDH1A1 (0.53) LMNANPSR1TDP1L3MBTL1HTT
SCHEMBL2060780 0.70 ALDH1A1 (0.53) LMNASMN1; SMN2NPSR1TDP1L3MBTL1
SCHEMBL2061280 0.70 MAPT (0.50) RECQLLMNASMN1; SMN2NPSR1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0775689-B9 NOVEL AMINE DERIVATIVE, PROCESS FOR PRODUCING THE SAME, AND USE THEREOF AS ANTIARRHYTHMIC C & C RES LABS (KR) 2004-09-15 EP disclosed
EP-0775689-B1 NOVEL AMINE DERIVATIVE, PROCESS FOR PRODUCING THE SAME, AND USE THEREOF AS ANTIARRHYTHMIC C & C RES LABS (KR) 2003-09-03 EP disclosed
US-6057358-A POTASSIUM CHANNEL BLOCKING ANTIARRHYTHMIC DRUGS WITH LESS SIDE EFFECTS C&C RESEARCH LABS. (KR) 2000-05-02 US disclosed
EP-0775689-A1 NOVEL AMINE DERIVATIVE, PROCESS FOR PRODUCING THE SAME, AND USE THEREOF AS ANTIARRHYTHMIC C & C RESEARCH LABS. (KR) 1997-05-28 EP disclosed