SCHEMBL8183239

SCHEMBL8183239

CCOC(=O)COc1ccc2ccn3c(N)c(-c4ccccc4C)nc3c2c1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.42
KMT2A Q03164 4/20 0.42
MAPK1 P28482 3/20 0.42
ALDH1A1 P00352 3/20 0.42
POLB P06746 2/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
MCL1 Q07820 1/20 0.41
MAPT P10636 5/20 0.39
TP53 P04637 3/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
HCRTR1 O43613 1/20 0.39
ALOX15 P16050 1/20 0.39
RAB9A P51151 1/20 0.39
GAA P10253 4/20 0.39
KDM4E B2RXH2 4/20 0.39
HSD17B10 Q99714 3/20 0.39
PSEN1 P49768 1/20 0.39
PSEN2 P49810 1/20 0.39
APH1B Q8WW43 1/20 0.39
NCSTN Q92542 1/20 0.39

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
SCHEMBL8187209 0.84 ALDH1A1 (0.40) KMT2AMAPK1ALDH1A1MCL1MAPT
SCHEMBL8183207 0.82 PKM (0.44) MEN1KMT2AMAPK1ALDH1A1POLB
SCHEMBL8183223 0.82 RAB9A (0.39) MEN1KMT2AMAPK1ALDH1A1POLB
SCHEMBL8183484 0.82 ATP4A (0.43) MEN1KMT2AALDH1A1L3MBTL1MAPT
SCHEMBL8183361 0.82 ALDH1A1 (0.38) KMT2AMAPK1ALDH1A1MAPTRAB9A
SCHEMBL8182317 0.81 KMT2A (0.43) KMT2AMAPK1ALDH1A1MAPTTP53
SCHEMBL8182429 0.80 ALDH1A1 (0.40) KMT2AMAPK1ALDH1A1MAPTTP53
SCHEMBL8183121 0.80 NCEH1 (0.39) KMT2AALDH1A1MAPTRAB9AGAA
SCHEMBL8183813 0.77 GAA (0.44) ALDH1A1MAPTTP53SMN1; SMN2RAB9A
SCHEMBL8174496 0.76 GAA (0.46) MEN1KMT2AALDH1A1POLBL3MBTL1

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
US-6103736-A SHOWING AN INHIBITORY ACTION ON GASTRIC ACID SECRETION AND A PROTECTIVE ACTION OF GASTRIC MUCOSA; 2-(HETERO)ARYL-3-AMINOIMIDAZO-(2,1-A)ISOQUINOLINES; ANTIULCER AGENTS; SHINNIPPON PHARMACEUTICAL INC. (JP) 2000-08-15 US disclosed
US-6020342-A Fused imidazo[1,2-A]pyridines SHINNIPPON PHARMACEUTICAL, INC. (JP) 2000-02-01 US disclosed
EP-0822194-A1 FUSED IMIDAZO 1,2-a]PYRIDINES Shinnippon Pharmaceutical Inc. (JP) 1998-02-04 EP disclosed