SCHEMBL8329868

SCHEMBL8329868

Cc1nc2n(CC(=O)c3ccccc3)cc(C#N)cc-2c1C

nearest known ligand 0.46

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.46
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
ALDH1A1 P00352 4/20 0.41
MAPT P10636 3/20 0.41
USP2 O75604 2/20 0.41
HTT P42858 2/20 0.41
RECQL P46063 1/20 0.41
HPGD P15428 1/20 0.41
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
POLB P06746 2/20 0.38
F11 P03951 1/20 0.37
HSD11B1 P28845 2/20 0.37
SRC P12931 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
SCHEMBL8331450 0.82 KMT2A (0.44) LMNAMEN1KMT2AMAPTHTT
SCHEMBL8325943 0.80 KMT2A (0.42) LMNAMEN1KMT2AALDH1A1MAPT
SCHEMBL8330358 0.79 KMT2A (0.41) LMNAMEN1KMT2AALDH1A1MAPT
SCHEMBL8326468 0.78 KMT2A (0.41) LMNAMEN1KMT2AMAPTHTT
SCHEMBL27372746 0.78 KMT2A (0.41) LMNAMEN1KMT2AMAPTHTT
SCHEMBL8326356 0.78 POLB (0.41) LMNAMEN1KMT2AGAAPOLB
SCHEMBL8329544 0.76 KMT2A (0.45) LMNAMEN1KMT2AALDH1A1MAPT
Hydrochloric Acid SCHEMBL8329003 0.75 KMT2A (0.44) LMNAMEN1KMT2AALDH1A1MAPT
SCHEMBL27373259 0.75 LMNA (0.44) LMNAMEN1KMT2AALDH1A1MAPT
SCHEMBL8327415 0.73 POLB (0.39) LMNAMEN1KMT2AALDH1A1MAPT

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-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-0580616-A1 NEW ACTIVE COMPOUNDS Astra Aktiebolag (SE) 1994-02-02 EP 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
WO-1992017477-A1 NEW ACTIVE COMPOUNDS AKTIEBOLAGET ASTRA (SE) 1992-10-15 WO disclosed