SCHEMBL22609271

SCHEMBL22609271

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

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.39
MEN1 O00255 3/20 0.39
KMT2A Q03164 3/20 0.39
LMNA P02545 2/20 0.39
RAB9A P51151 2/20 0.39
MAPK1 P28482 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
RXFP1 Q9HBX9 1/20 0.39
MGLL Q99685 1/20 0.37
MAOB P27338 3/20 0.36
LDHA P00338 1/20 0.36
NCEH1 Q6PIU2 1/20 0.34
ELANE P08246 1/20 0.34
ALDH1A1 P00352 2/20 0.34
NPC1 O15118 1/20 0.34
ATM Q13315 1/20 0.34
MAOA P21397 2/20 0.33
CHRNA7 P36544 1/20 0.33
THRB P10828 1/20 0.33
POLB P06746 1/20 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
SCHEMBL6671103 0.80 MAPT (0.47) MAPTMEN1KMT2ALMNARAB9A
SCHEMBL449938 0.73 ELANE (0.59) MAPTMEN1KMT2ALMNARAB9A
SCHEMBL154474 0.72 LMNA (0.64) MAPTMEN1KMT2ALMNARAB9A
SCHEMBL11579928 0.70 LMNA (0.61) MAPTMEN1KMT2ALMNARAB9A
SCHEMBL28599109 0.70 LMNA (0.61) MAPTMEN1KMT2ALMNARAB9A
SCHEMBL10140684 0.70 KMT2A (0.41) MEN1KMT2ANPC1POLB
SCHEMBL14125424 0.68 LDHA (0.40) MAPTMEN1KMT2ALMNARAB9A
SCHEMBL1290072 0.68 MGLL (0.47) MAPTMEN1KMT2ALMNARAB9A
SCHEMBL11721534 0.68 TDP1 (0.40) MAPTRAB9AELANEALDH1A1NPC1
SCHEMBL10237396 0.67 LMNA (0.57) MAPTMEN1KMT2ALMNARAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3731840-A1 GLYCOLATE OXIDASE INHIBITORS AND USE THEREOF Orfan Biotech Inc. (US) 2020-11-04 EP disclosed