SCHEMBL8327565

SCHEMBL8327565

Cc1c2cc(Br)cn(CC(=O)c3ccccc3)c-2nc1-c1ccccc1

nearest known ligand 0.41

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.41
MEN1 O00255 1/20 0.41
MAPT P10636 1/20 0.39
HTT P42858 1/20 0.39
MGAM O43451 1/20 0.39
AMY1A P0DUB6 1/20 0.39
GAA P10253 1/20 0.39
SI P14410 1/20 0.39
MGAM2 Q2M2H8 1/20 0.39
ALPL P05186 2/20 0.38
PLAA Q9Y263 2/20 0.38
SRC P12931 2/20 0.38
HPGD P15428 1/20 0.38
MKNK1 Q9BUB5 1/20 0.38
MKNK2 Q9HBH9 1/20 0.38
ALPG P10696 1/20 0.37
POLB P06746 1/20 0.37
PTGFR P43088 2/20 0.37

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
SCHEMBL8331450 0.87 KMT2A (0.44) KMT2AMEN1MAPTHTTMGAM
SCHEMBL9387149 0.85 PTGFR (0.38) KMT2AMEN1MKNK2PTGFR
SCHEMBL8328480 0.81 MEN1 (0.42) KMT2AMEN1MGAMAMY1AGAA
SCHEMBL8327249 0.81 GSK3B (0.42) KMT2AMEN1MAPTHTTMGAM
SCHEMBL8326687 0.75 SRC (0.46) KMT2AMEN1MAPTMGAMAMY1A
SCHEMBL8330358 0.72 KMT2A (0.41) KMT2AMEN1MAPTHTTMGAM
SCHEMBL8322914 0.72 NPC1 (0.46) MAPTMGAMAMY1AGAASI
SCHEMBL8327343 0.71 ALDH1A1 (0.46) MAPTHPGD
SCHEMBL8325943 0.71 KMT2A (0.42) KMT2AMEN1MAPTHTTMGAM
SCHEMBL12391289 0.70 GPR35 (0.46) KMT2AMEN1MAPTMGAMAMY1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0509974-B1 Pyrrolo[2,3-b]pyridines having therapeutic activity and a process for the preparation thereof ASTRA AB (SE) 1999-01-13 EP disclosed
US-5439917-A Phenyl-pyrrolo(2,3-b)pyridine antisecretory agent of gastric acid; adenosine triphosphatase enzyme inhibitor AKTIEBOLAGET ASTRA (SE) 1995-08-08 US disclosed
EP-0509974-A1 Pyrrolo[2,3-b]pyridines having therapeutic activity and a process for the preparation thereof Astra Aktiebolag (SE) 1992-10-21 EP disclosed