SCHEMBL8183207

SCHEMBL8183207

CC(=O)Oc1ccc2ccn3c(N)c(-c4ccccc4C)nc3c2c1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PKM P14618 1/20 0.44
KDM4E B2RXH2 6/20 0.39
RAB9A P51151 5/20 0.39
NPC1 O15118 4/20 0.39
GLA P06280 4/20 0.39
HPGD P15428 3/20 0.39
ALDH1A1 P00352 3/20 0.39
HSD17B10 Q99714 3/20 0.39
GAA P10253 3/20 0.39
ATM Q13315 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
MAPT P10636 3/20 0.38
SMN1; SMN2 Q16637 4/20 0.37
POLB P06746 2/20 0.35
KMT2A Q03164 3/20 0.35
RXFP1 Q9HBX9 2/20 0.35
CASP1 P29466 1/20 0.35
CASP7 P55210 1/20 0.35
HTT P42858 1/20 0.34
MEN1 O00255 1/20 0.34

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
SCHEMBL8183223 0.91 RAB9A (0.39) PKMKDM4ERAB9ANPC1GLA
SCHEMBL8183121 0.89 NCEH1 (0.39) PKMKDM4ERAB9ANPC1GLA
SCHEMBL8172171 0.88 ALDH1A1 (0.45) PKMKDM4ERAB9ANPC1GLA
SCHEMBL8182429 0.87 ALDH1A1 (0.40) PKMKDM4ERAB9ANPC1GLA
SCHEMBL8182317 0.86 KMT2A (0.43) KDM4ERAB9ANPC1GLAHPGD
SCHEMBL8183239 0.82 MEN1 (0.42) KDM4ERAB9AGLAHPGDALDH1A1
SCHEMBL8187209 0.82 ALDH1A1 (0.40) KDM4ERAB9ANPC1GLAHPGD
SCHEMBL8183813 0.81 GAA (0.44) KDM4ERAB9ANPC1GLAHPGD
SCHEMBL8174496 0.81 GAA (0.46) KDM4ERAB9ANPC1GLAHPGD
SCHEMBL8183361 0.80 ALDH1A1 (0.38) KDM4ERAB9ANPC1GLAHPGD

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