SCHEMBL8182995

SCHEMBL8182995

Cc1ccccc1-c1nc2c3cc(-c4ccccc4)ccc3ccn2c1N

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.52
ALDH1A1 P00352 2/20 0.52
GAA P10253 2/20 0.52
NPC1 O15118 2/20 0.52
GLA P06280 1/20 0.52
HPGD P15428 1/20 0.52
RAB9A P51151 1/20 0.52
ATM Q13315 1/20 0.52
NPSR1 Q6W5P4 1/20 0.52
HSD17B10 Q99714 1/20 0.52
ADORA2A P29274 1/20 0.39
BACE1 P56817 2/20 0.38
CTSD P07339 1/20 0.38
DPP4 P27487 2/20 0.38
MAPT P10636 4/20 0.37
AKT1 P31749 3/20 0.35
AKT2 P31751 2/20 0.35
TP53 P04637 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
KMT2A Q03164 2/20 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
SCHEMBL8174496 0.86 GAA (0.46) KDM4EALDH1A1GAANPC1GLA
SCHEMBL8183813 0.84 GAA (0.44) KDM4EALDH1A1GAANPC1GLA
SCHEMBL8182279 0.84 ALDH1A1 (0.44) KDM4EALDH1A1GAANPC1GLA
SCHEMBL8182205 0.84 ALDH1A1 (0.44) KDM4EALDH1A1GAANPC1GLA
SCHEMBL8182199 0.83 KDM4E (0.50) KDM4EALDH1A1GAANPC1GLA
SCHEMBL8189280 0.82 GAA (0.42) KDM4EALDH1A1GAANPC1GLA
SCHEMBL8182317 0.82 KMT2A (0.43) KDM4EALDH1A1GAANPC1GLA
SCHEMBL8189166 0.81 ALDH1A1 (0.41) KDM4EALDH1A1GAANPC1GLA
SCHEMBL8182429 0.80 ALDH1A1 (0.40) KDM4EALDH1A1GAANPC1GLA
SCHEMBL8187209 0.79 ALDH1A1 (0.40) KDM4EALDH1A1GAANPC1GLA

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