SCHEMBL9570463

SCHEMBL9570463

[O]CCn1cnc2cc([N+](=O)[O-])ccc21

nearest known ligand 0.70

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PKM P14618 2/20 0.70
ALDH1A1 P00352 5/20 0.55
BRD4 O60885 1/20 0.53
KCNH2 Q12809 1/20 0.53
MAPT P10636 4/20 0.52
HPGD P15428 1/20 0.49
FGFR1 P11362 1/20 0.48
L3MBTL1 Q9Y468 3/20 0.46
SMN1; SMN2 Q16637 2/20 0.46
NR1I2 O75469 1/20 0.46
HTT P42858 3/20 0.46
POLB P06746 1/20 0.46
MAPK1 P28482 1/20 0.46
LMNA P02545 1/20 0.46
TDP1 Q9NUW8 1/20 0.46
KMT2A Q03164 2/20 0.45
KDM4E B2RXH2 1/20 0.45
GAA P10253 1/20 0.45

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
SCHEMBL7034458 0.87 PKM (0.68) PKMALDH1A1BRD4KCNH2MAPT
SCHEMBL19911366 0.87 PKM (0.68) PKMALDH1A1BRD4KCNH2MAPT
SCHEMBL9039302 0.86 PKM (0.67) PKMALDH1A1BRD4KCNH2MAPT
SCHEMBL11559748 0.85 PKM (0.65) PKMALDH1A1BRD4KCNH2MAPT
SCHEMBL7353128 0.85 PKM (0.65) PKMALDH1A1BRD4KCNH2MAPT
SCHEMBL19911377 0.84 PKM (0.64) PKMALDH1A1BRD4KCNH2MAPT
SCHEMBL11797084 0.84 PKM (0.64) PKMALDH1A1BRD4KCNH2MAPT
SCHEMBL2841823 0.82 PKM (1.00) PKMALDH1A1BRD4KCNH2MAPT
SCHEMBL2074112 0.82 PKM (0.62) PKMALDH1A1BRD4KCNH2MAPT
SCHEMBL520932 0.80 PKM (0.60) PKMALDH1A1BRD4KCNH2MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5270322-A Imidazo[1,2-a]pyridines, pharmaceutical compositions containing these compounds and processes for preparing them DR. KARL THOMAE GMBH (DE) 1993-12-14 US disclosed
EP-0555825-A1 Imidazo(1,2-a)pyridines as angiotensin-II-antagonists Dr. Karl Thomae GmbH (DE) 1993-08-18 EP disclosed